NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
628746 | 6cxn | 30446 | cing | 4-filtered-FRED | STAR | entry | full | 47 |
data_FRED_restraints_with_modified_coordinates_PDB_code_6cxn # This FRED archive file contains, for PDB entry <6cxn>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.PDB_coordinate_file_version . _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_6cxn _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 6cxn _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 853.03 loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 . 1 $Hexapeptide_HRFLRH A . 1 1 stop_ save_ save_Hexapeptide_HRFLRH _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Hexapeptide HRFLRH" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code HRFLRHX _Entity.Number_of_monomers 7 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 HIS . 1 1 2 ARG . 1 1 3 PHE . 1 1 4 LEU . 1 1 5 ARG . 1 1 6 HIS . 1 1 7 NH2 $NH2 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID HIS 1 1 1 1 ARG 2 2 1 1 PHE 3 3 1 1 LEU 4 4 1 1 ARG 5 5 1 1 HIS 6 6 1 1 NH2 7 7 1 1 stop_ save_ save_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID NH2 _Chem_comp.Type non-polymer save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 HIS HA . 1 . HA 1 1 1 1 2 1 1 1 HIS QB . 1 . HB# 1 1 2 1 1 1 1 1 HIS HA . 1 . HA 1 1 2 1 2 1 1 1 HIS HD2 . 1 . HD2 1 1 3 1 1 1 1 1 HIS HA . 1 . HA 1 1 3 1 2 1 1 2 ARG H . 2 . HN 1 1 4 1 1 1 1 1 HIS HA . 1 . HA 1 1 4 1 2 1 1 2 ARG QB . 2 . HB# 1 1 5 1 1 1 1 1 HIS QB . 1 . HB# 1 1 5 1 2 1 1 1 HIS HD2 . 1 . HD2 1 1 6 1 1 1 1 2 ARG HA . 2 . HA 1 1 6 1 2 1 1 2 ARG QB . 2 . HB# 1 1 7 1 1 1 1 2 ARG HA . 2 . HA 1 1 7 1 2 1 1 2 ARG QD . 2 . HD# 1 1 8 1 1 1 1 2 ARG HA . 2 . HA 1 1 8 1 2 1 1 3 PHE H . 3 . HN 1 1 9 1 1 1 1 2 ARG HA . 2 . HA 1 1 9 1 2 1 1 3 PHE HD1 . 3 . HD1 1 1 10 1 1 1 1 2 ARG QB . 2 . HB# 1 1 10 1 2 1 1 2 ARG QD . 2 . HD# 1 1 11 1 1 1 1 2 ARG QB . 2 . HB# 1 1 11 1 2 1 1 3 PHE H . 3 . HN 1 1 12 1 1 1 1 3 PHE H . 3 . HN 1 1 12 1 2 1 1 3 PHE HB2 . 3 . HB2 1 1 13 1 1 1 1 3 PHE H . 3 . HN 1 1 13 1 2 1 1 3 PHE HB3 . 3 . HB1 1 1 14 1 1 1 1 3 PHE H . 3 . HN 1 1 14 1 2 1 1 3 PHE QD . 3 . HD# 1 1 15 1 1 1 1 3 PHE HA . 3 . HA 1 1 15 1 2 1 1 3 PHE HB2 . 3 . HB2 1 1 16 1 1 1 1 3 PHE HA . 3 . HA 1 1 16 1 2 1 1 3 PHE HB3 . 3 . HB1 1 1 17 1 1 1 1 3 PHE HA . 3 . HA 1 1 17 1 2 1 1 4 LEU H . 4 . HN 1 1 18 1 1 1 1 3 PHE HB2 . 3 . HB2 1 1 18 1 2 1 1 3 PHE QD . 3 . HD# 1 1 19 1 1 1 1 3 PHE HB2 . 3 . HB2 1 1 19 1 2 1 1 4 LEU H . 4 . HN 1 1 20 1 1 1 1 3 PHE HB3 . 3 . HB1 1 1 20 1 2 1 1 3 PHE QD . 3 . HD# 1 1 21 1 1 1 1 3 PHE HB3 . 3 . HB1 1 1 21 1 2 1 1 4 LEU H . 4 . HN 1 1 22 1 1 1 1 3 PHE HD1 . 3 . HD1 1 1 22 1 2 1 1 4 LEU HG . 4 . HG 1 1 23 1 1 1 1 4 LEU H . 4 . HN 1 1 23 1 2 1 1 4 LEU QB . 4 . HB# 1 1 24 1 1 1 1 4 LEU H . 4 . HN 1 1 24 1 2 1 1 4 LEU HG . 4 . HG 1 1 25 1 1 1 1 4 LEU HA . 4 . HA 1 1 25 1 2 1 1 4 LEU QB . 4 . HB# 1 1 26 1 1 1 1 4 LEU HA . 4 . HA 1 1 26 1 2 1 1 4 LEU MD1 . 4 . HD1# 1 1 27 1 1 1 1 4 LEU HA . 4 . HA 1 1 27 1 2 1 1 4 LEU HG . 4 . HG 1 1 28 1 1 1 1 4 LEU HA . 4 . HA 1 1 28 1 2 1 1 5 ARG H . 5 . HN 1 1 29 1 1 1 1 4 LEU QB . 4 . HB# 1 1 29 1 2 1 1 4 LEU MD2 . 4 . HD2# 1 1 30 1 1 1 1 5 ARG H . 5 . HN 1 1 30 1 2 1 1 5 ARG HB3 . 5 . HB1 1 1 31 1 1 1 1 5 ARG H . 5 . HN 1 1 31 1 2 1 1 5 ARG HG2 . 5 . HG2 1 1 32 1 1 1 1 5 ARG HA . 5 . HA 1 1 32 1 2 1 1 5 ARG HB2 . 5 . HB2 1 1 33 1 1 1 1 5 ARG HA . 5 . HA 1 1 33 1 2 1 1 5 ARG QD . 5 . HD# 1 1 34 1 1 1 1 5 ARG HA . 5 . HA 1 1 34 1 2 1 1 5 ARG HG2 . 5 . HG2 1 1 35 1 1 1 1 5 ARG HA . 5 . HA 1 1 35 1 2 1 1 5 ARG HG3 . 5 . HG1 1 1 36 1 1 1 1 5 ARG HA . 5 . HA 1 1 36 1 2 1 1 6 HIS H . 6 . HN 1 1 37 1 1 1 1 5 ARG HA . 5 . HA 1 1 37 1 2 1 1 6 HIS HD2 . 6 . HD2 1 1 38 1 1 1 1 5 ARG HB2 . 5 . HB2 1 1 38 1 2 1 1 5 ARG QD . 5 . HD# 1 1 39 1 1 1 1 5 ARG HB2 . 5 . HB2 1 1 39 1 2 1 1 5 ARG HG2 . 5 . HG2 1 1 40 1 1 1 1 5 ARG HB2 . 5 . HB2 1 1 40 1 2 1 1 5 ARG HG3 . 5 . HG1 1 1 41 1 1 1 1 5 ARG HB3 . 5 . HB1 1 1 41 1 2 1 1 5 ARG QD . 5 . HD# 1 1 42 1 1 1 1 5 ARG HB3 . 5 . HB1 1 1 42 1 2 1 1 6 HIS H . 6 . HN 1 1 43 1 1 1 1 5 ARG HE . 5 . HE 1 1 43 1 2 1 1 6 HIS HA . 6 . HA 1 1 44 1 1 1 1 6 HIS H . 6 . HN 1 1 44 1 2 1 1 6 HIS HB3 . 6 . HB1 1 1 45 1 1 1 1 6 HIS HA . 6 . HA 1 1 45 1 2 1 1 6 HIS HB2 . 6 . HB2 1 1 46 1 1 1 1 6 HIS HA . 6 . HA 1 1 46 1 2 1 1 6 HIS HB3 . 6 . HB1 1 1 47 1 1 1 1 6 HIS HA . 6 . HA 1 1 47 1 2 1 1 6 HIS HD2 . 6 . HD2 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . 1.8 2.8 1 1 2 1 . . . . . 5.0 1.8 5.0 1 1 3 1 . . . . . 5.0 1.8 5.0 1 1 4 1 . . . . . 5.0 1.8 5.0 1 1 5 1 . . . . . 3.4 1.8 3.4 1 1 6 1 . . . . . 2.8 1.8 2.8 1 1 7 1 . . . . . 5.0 1.8 5.0 1 1 8 1 . . . . . 2.8 1.8 2.8 1 1 9 1 . . . . . 5.0 1.8 5.0 1 1 10 1 . . . . . 2.8 1.8 2.8 1 1 11 1 . . . . . 5.0 1.8 5.0 1 1 12 1 . . . . . 3.4 1.8 3.4 1 1 13 1 . . . . . 3.4 1.8 3.4 1 1 14 1 . . . . . 5.0 1.8 5.0 1 1 15 1 . . . . . 2.8 1.8 2.8 1 1 16 1 . . . . . 2.8 1.8 2.8 1 1 17 1 . . . . . 2.8 1.8 2.8 1 1 18 1 . . . . . 2.8 1.8 2.8 1 1 19 1 . . . . . 5.0 1.8 5.0 1 1 20 1 . . . . . 2.8 1.8 2.8 1 1 21 1 . . . . . 5.0 1.8 5.0 1 1 22 1 . . . . . 5.0 1.8 5.0 1 1 23 1 . . . . . 3.4 1.8 3.4 1 1 24 1 . . . . . 2.8 1.8 2.8 1 1 25 1 . . . . . . 1.8 2.8 1 1 26 1 . . . . . 3.4 1.8 3.4 1 1 27 1 . . . . . . 1.8 2.8 1 1 28 1 . . . . . 2.8 1.8 2.8 1 1 29 1 . . . . . 2.8 1.8 2.8 1 1 30 1 . . . . . . 1.8 3.4 1 1 31 1 . . . . . 5.0 1.8 5.0 1 1 32 1 . . . . . . 1.8 2.8 1 1 33 1 . . . . . 3.4 1.8 3.4 1 1 34 1 . . . . . 3.4 1.8 3.4 1 1 35 1 . . . . . 3.4 1.8 3.4 1 1 36 1 . . . . . 2.8 1.8 2.8 1 1 37 1 . . . . . 5.0 1.8 5.0 1 1 38 1 . . . . . 3.4 1.8 3.4 1 1 39 1 . . . . . 2.8 1.8 2.8 1 1 40 1 . . . . . 2.8 1.8 2.8 1 1 41 1 . . . . . 2.8 1.8 2.8 1 1 42 1 . . . . . 5.0 1.8 5.0 1 1 43 1 . . . . . 5.0 1.8 5.0 1 1 44 1 . . . . . 3.4 1.8 3.4 1 1 45 1 . . . . . 2.8 1.8 2.8 1 1 46 1 . . . . . 2.8 1.8 2.8 1 1 47 1 . . . . . 5.0 1.8 5.0 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 HIS C C 0.199 -6.621 2.984 1.00 . A A . 1 HIS C 1 1 1 2 1 1 1 HIS CA C 0.450 -7.978 2.335 1.00 . A A . 1 HIS CA 1 1 1 3 1 1 1 HIS CB C 1.808 -7.984 1.631 1.00 . A A . 1 HIS CB 1 1 1 4 1 1 1 HIS CD2 C 1.996 -9.551 -0.428 1.00 . A A . 1 HIS CD2 1 1 1 5 1 1 1 HIS CE1 C 2.695 -11.354 0.606 1.00 . A A . 1 HIS CE1 1 1 1 6 1 1 1 HIS CG C 2.092 -9.253 0.890 1.00 . A A . 1 HIS CG 1 1 1 7 1 1 1 HIS H1 H -0.536 -9.314 1.119 1.00 . A A . 1 HIS H1 1 1 1 8 1 1 1 HIS H2 H -0.422 -7.721 0.490 1.00 . A A . 1 HIS H2 1 1 1 9 1 1 1 HIS H3 H -1.523 -8.068 1.760 1.00 . A A . 1 HIS H3 1 1 1 10 1 1 1 HIS HA H 0.442 -8.741 3.099 1.00 . A A . 1 HIS HA 1 1 1 11 1 1 1 HIS HB2 H 1.840 -7.171 0.921 1.00 . A A . 1 HIS HB2 1 1 1 12 1 1 1 HIS HB3 H 2.587 -7.845 2.366 1.00 . A A . 1 HIS HB3 1 1 1 13 1 1 1 HIS HD1 H 2.700 -10.509 2.470 1.00 . A A . 1 HIS HD1 1 1 1 14 1 1 1 HIS HD2 H 1.680 -8.881 -1.215 1.00 . A A . 1 HIS HD2 1 1 1 15 1 1 1 HIS HE1 H 3.030 -12.362 0.802 1.00 . A A . 1 HIS HE1 1 1 1 16 1 1 1 HIS HE2 H 2.320 -11.379 -1.407 1.00 . A A . 1 HIS HE2 1 1 1 17 1 1 1 HIS N N -0.603 -8.299 1.336 1.00 . A A . 1 HIS N 1 1 1 18 1 1 1 HIS ND1 N 2.531 -10.404 1.510 1.00 . A A . 1 HIS ND1 1 1 1 19 1 1 1 HIS NE2 N 2.376 -10.862 -0.577 1.00 . A A . 1 HIS NE2 1 1 1 20 1 1 1 HIS O O -0.060 -6.534 4.184 1.00 . A A . 1 HIS O 1 1 1 21 1 1 2 ARG C C -0.805 -3.407 1.714 1.00 . A A . 2 ARG C 1 1 1 22 1 1 2 ARG CA C 0.061 -4.210 2.679 1.00 . A A . 2 ARG CA 1 1 1 23 1 1 2 ARG CB C 1.400 -3.501 2.891 1.00 . A A . 2 ARG CB 1 1 1 24 1 1 2 ARG CD C 2.388 -2.848 5.111 1.00 . A A . 2 ARG CD 1 1 1 25 1 1 2 ARG CG C 1.379 -2.493 4.030 1.00 . A A . 2 ARG CG 1 1 1 26 1 1 2 ARG CZ C 3.035 -1.969 7.320 1.00 . A A . 2 ARG CZ 1 1 1 27 1 1 2 ARG H H 0.489 -5.697 1.234 1.00 . A A . 2 ARG H 1 1 1 28 1 1 2 ARG HA H -0.451 -4.283 3.626 1.00 . A A . 2 ARG HA 1 1 1 29 1 1 2 ARG HB2 H 2.156 -4.242 3.106 1.00 . A A . 2 ARG HB2 1 1 1 30 1 1 2 ARG HB3 H 1.666 -2.981 1.983 1.00 . A A . 2 ARG HB3 1 1 1 31 1 1 2 ARG HD2 H 2.064 -3.753 5.604 1.00 . A A . 2 ARG HD2 1 1 1 32 1 1 2 ARG HD3 H 3.349 -3.016 4.648 1.00 . A A . 2 ARG HD3 1 1 1 33 1 1 2 ARG HE H 2.206 -0.892 5.859 1.00 . A A . 2 ARG HE 1 1 1 34 1 1 2 ARG HG2 H 1.618 -1.516 3.636 1.00 . A A . 2 ARG HG2 1 1 1 35 1 1 2 ARG HG3 H 0.390 -2.476 4.464 1.00 . A A . 2 ARG HG3 1 1 1 36 1 1 2 ARG HH11 H 3.413 -3.939 7.060 1.00 . A A . 2 ARG HH11 1 1 1 37 1 1 2 ARG HH12 H 3.858 -3.295 8.605 1.00 . A A . 2 ARG HH12 1 1 1 38 1 1 2 ARG HH21 H 2.790 -0.045 7.890 1.00 . A A . 2 ARG HH21 1 1 1 39 1 1 2 ARG HH22 H 3.504 -1.086 9.077 1.00 . A A . 2 ARG HH22 1 1 1 40 1 1 2 ARG N N 0.279 -5.564 2.182 1.00 . A A . 2 ARG N 1 1 1 41 1 1 2 ARG NE N 2.519 -1.787 6.107 1.00 . A A . 2 ARG NE 1 1 1 42 1 1 2 ARG NH1 N 3.471 -3.166 7.692 1.00 . A A . 2 ARG NH1 1 1 1 43 1 1 2 ARG NH2 N 3.117 -0.949 8.165 1.00 . A A . 2 ARG NH2 1 1 1 44 1 1 2 ARG O O -1.181 -3.895 0.648 1.00 . A A . 2 ARG O 1 1 1 45 1 1 3 PHE C C -1.109 -0.620 0.192 1.00 . A A . 3 PHE C 1 1 1 46 1 1 3 PHE CA C -1.944 -1.304 1.267 1.00 . A A . 3 PHE CA 1 1 1 47 1 1 3 PHE CB C -2.653 -0.260 2.127 1.00 . A A . 3 PHE CB 1 1 1 48 1 1 3 PHE CD1 C -4.890 -1.222 1.479 1.00 . A A . 3 PHE CD1 1 1 1 49 1 1 3 PHE CD2 C -4.740 1.118 1.917 1.00 . A A . 3 PHE CD2 1 1 1 50 1 1 3 PHE CE1 C -6.239 -1.089 1.213 1.00 . A A . 3 PHE CE1 1 1 1 51 1 1 3 PHE CE2 C -6.090 1.256 1.652 1.00 . A A . 3 PHE CE2 1 1 1 52 1 1 3 PHE CG C -4.124 -0.121 1.834 1.00 . A A . 3 PHE CG 1 1 1 53 1 1 3 PHE CZ C -6.840 0.152 1.299 1.00 . A A . 3 PHE CZ 1 1 1 54 1 1 3 PHE H H -0.793 -1.843 2.959 1.00 . A A . 3 PHE H 1 1 1 55 1 1 3 PHE HA H -2.683 -1.913 0.785 1.00 . A A . 3 PHE HA 1 1 1 56 1 1 3 PHE HB2 H -2.547 -0.530 3.171 1.00 . A A . 3 PHE HB2 1 1 1 57 1 1 3 PHE HB3 H -2.189 0.698 1.954 1.00 . A A . 3 PHE HB3 1 1 1 58 1 1 3 PHE HD1 H -4.422 -2.193 1.409 1.00 . A A . 3 PHE HD1 1 1 1 59 1 1 3 PHE HD2 H -4.155 1.983 2.193 1.00 . A A . 3 PHE HD2 1 1 1 60 1 1 3 PHE HE1 H -6.824 -1.954 0.937 1.00 . A A . 3 PHE HE1 1 1 1 61 1 1 3 PHE HE2 H -6.557 2.228 1.720 1.00 . A A . 3 PHE HE2 1 1 1 62 1 1 3 PHE HZ H -7.894 0.258 1.092 1.00 . A A . 3 PHE HZ 1 1 1 63 1 1 3 PHE N N -1.121 -2.175 2.097 1.00 . A A . 3 PHE N 1 1 1 64 1 1 3 PHE O O 0.120 -0.688 0.206 1.00 . A A . 3 PHE O 1 1 1 65 1 1 4 LEU C C -0.839 2.183 -1.472 1.00 . A A . 4 LEU C 1 1 1 66 1 1 4 LEU CA C -1.116 0.727 -1.833 1.00 . A A . 4 LEU CA 1 1 1 67 1 1 4 LEU CB C -1.956 0.652 -3.107 1.00 . A A . 4 LEU CB 1 1 1 68 1 1 4 LEU CD1 C -3.966 -0.744 -2.609 1.00 . A A . 4 LEU CD1 1 1 1 69 1 1 4 LEU CD2 C -2.831 -0.945 -4.830 1.00 . A A . 4 LEU CD2 1 1 1 70 1 1 4 LEU CG C -2.639 -0.694 -3.342 1.00 . A A . 4 LEU CG 1 1 1 71 1 1 4 LEU H H -2.766 0.048 -0.699 1.00 . A A . 4 LEU H 1 1 1 72 1 1 4 LEU HA H -0.182 0.226 -2.006 1.00 . A A . 4 LEU HA 1 1 1 73 1 1 4 LEU HB2 H -2.716 1.418 -3.059 1.00 . A A . 4 LEU HB2 1 1 1 74 1 1 4 LEU HB3 H -1.314 0.857 -3.951 1.00 . A A . 4 LEU HB3 1 1 1 75 1 1 4 LEU HD11 H -4.137 0.200 -2.114 1.00 . A A . 4 LEU HD11 1 1 1 76 1 1 4 LEU HD12 H -3.936 -1.533 -1.873 1.00 . A A . 4 LEU HD12 1 1 1 77 1 1 4 LEU HD13 H -4.763 -0.935 -3.311 1.00 . A A . 4 LEU HD13 1 1 1 78 1 1 4 LEU HD21 H -2.671 -1.992 -5.042 1.00 . A A . 4 LEU HD21 1 1 1 79 1 1 4 LEU HD22 H -2.123 -0.352 -5.390 1.00 . A A . 4 LEU HD22 1 1 1 80 1 1 4 LEU HD23 H -3.836 -0.670 -5.115 1.00 . A A . 4 LEU HD23 1 1 1 81 1 1 4 LEU HG H -2.014 -1.480 -2.944 1.00 . A A . 4 LEU HG 1 1 1 82 1 1 4 LEU N N -1.789 0.035 -0.743 1.00 . A A . 4 LEU N 1 1 1 83 1 1 4 LEU O O -1.566 2.787 -0.684 1.00 . A A . 4 LEU O 1 1 1 84 1 1 5 ARG C C 1.185 4.773 -3.042 1.00 . A A . 5 ARG C 1 1 1 85 1 1 5 ARG CA C 0.592 4.126 -1.795 1.00 . A A . 5 ARG CA 1 1 1 86 1 1 5 ARG CB C 1.594 4.199 -0.644 1.00 . A A . 5 ARG CB 1 1 1 87 1 1 5 ARG CD C 2.623 6.477 -0.411 1.00 . A A . 5 ARG CD 1 1 1 88 1 1 5 ARG CG C 1.556 5.523 0.099 1.00 . A A . 5 ARG CG 1 1 1 89 1 1 5 ARG CZ C 2.833 8.869 -0.966 1.00 . A A . 5 ARG CZ 1 1 1 90 1 1 5 ARG H H 0.759 2.207 -2.674 1.00 . A A . 5 ARG H 1 1 1 91 1 1 5 ARG HA H -0.300 4.664 -1.515 1.00 . A A . 5 ARG HA 1 1 1 92 1 1 5 ARG HB2 H 1.374 3.407 0.062 1.00 . A A . 5 ARG HB2 1 1 1 93 1 1 5 ARG HB3 H 2.593 4.060 -1.040 1.00 . A A . 5 ARG HB3 1 1 1 94 1 1 5 ARG HD2 H 3.497 6.389 0.216 1.00 . A A . 5 ARG HD2 1 1 1 95 1 1 5 ARG HD3 H 2.878 6.201 -1.424 1.00 . A A . 5 ARG HD3 1 1 1 96 1 1 5 ARG HE H 1.323 8.060 0.057 1.00 . A A . 5 ARG HE 1 1 1 97 1 1 5 ARG HG2 H 0.586 5.976 -0.041 1.00 . A A . 5 ARG HG2 1 1 1 98 1 1 5 ARG HG3 H 1.721 5.340 1.149 1.00 . A A . 5 ARG HG3 1 1 1 99 1 1 5 ARG HH11 H 4.353 7.716 -1.639 1.00 . A A . 5 ARG HH11 1 1 1 100 1 1 5 ARG HH12 H 4.476 9.401 -2.017 1.00 . A A . 5 ARG HH12 1 1 1 101 1 1 5 ARG HH21 H 1.483 10.277 -0.439 1.00 . A A . 5 ARG HH21 1 1 1 102 1 1 5 ARG HH22 H 2.848 10.856 -1.336 1.00 . A A . 5 ARG HH22 1 1 1 103 1 1 5 ARG N N 0.218 2.740 -2.054 1.00 . A A . 5 ARG N 1 1 1 104 1 1 5 ARG NE N 2.168 7.865 -0.398 1.00 . A A . 5 ARG NE 1 1 1 105 1 1 5 ARG NH1 N 3.982 8.643 -1.592 1.00 . A A . 5 ARG NH1 1 1 1 106 1 1 5 ARG NH2 N 2.348 10.101 -0.909 1.00 . A A . 5 ARG NH2 1 1 1 107 1 1 5 ARG O O 2.011 4.174 -3.732 1.00 . A A . 5 ARG O 1 1 1 108 1 1 6 HIS C C 1.068 8.231 -4.308 1.00 . A A . 6 HIS C 1 1 1 109 1 1 6 HIS CA C 1.247 6.727 -4.491 1.00 . A A . 6 HIS CA 1 1 1 110 1 1 6 HIS CB C 0.514 6.264 -5.751 1.00 . A A . 6 HIS CB 1 1 1 111 1 1 6 HIS CD2 C -1.716 7.214 -4.825 1.00 . A A . 6 HIS CD2 1 1 1 112 1 1 6 HIS CE1 C -3.050 6.506 -6.415 1.00 . A A . 6 HIS CE1 1 1 1 113 1 1 6 HIS CG C -0.957 6.543 -5.724 1.00 . A A . 6 HIS CG 1 1 1 114 1 1 6 HIS H H 0.099 6.424 -2.739 1.00 . A A . 6 HIS H 1 1 1 115 1 1 6 HIS HA H 2.299 6.512 -4.598 1.00 . A A . 6 HIS HA 1 1 1 116 1 1 6 HIS HB2 H 0.933 6.773 -6.611 1.00 . A A . 6 HIS HB2 1 1 1 117 1 1 6 HIS HB3 H 0.649 5.194 -5.864 1.00 . A A . 6 HIS HB3 1 1 1 118 1 1 6 HIS HD1 H -1.575 5.595 -7.502 1.00 . A A . 6 HIS HD1 1 1 1 119 1 1 6 HIS HD2 H -1.366 7.690 -3.920 1.00 . A A . 6 HIS HD2 1 1 1 120 1 1 6 HIS HE1 H -3.933 6.312 -7.004 1.00 . A A . 6 HIS HE1 1 1 1 121 1 1 6 HIS HE2 H -3.795 7.505 -4.789 1.00 . A A . 6 HIS HE2 1 1 1 122 1 1 6 HIS N N 0.758 5.999 -3.326 1.00 . A A . 6 HIS N 1 1 1 123 1 1 6 HIS ND1 N -1.823 6.112 -6.707 1.00 . A A . 6 HIS ND1 1 1 1 124 1 1 6 HIS NE2 N -3.011 7.176 -5.278 1.00 . A A . 6 HIS NE2 1 1 1 125 1 1 6 HIS O O 0.555 8.641 -3.246 1.00 . A A . 6 HIS O 1 1 2 126 1 1 1 HIS C C -0.310 -6.590 3.044 1.00 . A A . 1 HIS C 1 1 2 127 1 1 1 HIS CA C -0.594 -8.010 2.565 1.00 . A A . 1 HIS CA 1 1 2 128 1 1 1 HIS CB C -1.380 -8.778 3.629 1.00 . A A . 1 HIS CB 1 1 2 129 1 1 1 HIS CD2 C -0.672 -8.631 6.120 1.00 . A A . 1 HIS CD2 1 1 2 130 1 1 1 HIS CE1 C 0.982 -10.068 6.069 1.00 . A A . 1 HIS CE1 1 1 2 131 1 1 1 HIS CG C -0.578 -9.097 4.852 1.00 . A A . 1 HIS CG 1 1 2 132 1 1 1 HIS H1 H 1.066 -8.367 1.403 1.00 . A A . 1 HIS H1 1 1 2 133 1 1 1 HIS H2 H 0.431 -9.754 2.190 1.00 . A A . 1 HIS H2 1 1 2 134 1 1 1 HIS H3 H 1.312 -8.584 3.086 1.00 . A A . 1 HIS H3 1 1 2 135 1 1 1 HIS HA H -1.174 -7.965 1.656 1.00 . A A . 1 HIS HA 1 1 2 136 1 1 1 HIS HB2 H -2.231 -8.187 3.935 1.00 . A A . 1 HIS HB2 1 1 2 137 1 1 1 HIS HB3 H -1.728 -9.709 3.206 1.00 . A A . 1 HIS HB3 1 1 2 138 1 1 1 HIS HD1 H 0.788 -10.504 4.079 1.00 . A A . 1 HIS HD1 1 1 2 139 1 1 1 HIS HD2 H -1.387 -7.906 6.486 1.00 . A A . 1 HIS HD2 1 1 2 140 1 1 1 HIS HE1 H 1.813 -10.690 6.367 1.00 . A A . 1 HIS HE1 1 1 2 141 1 1 1 HIS HE2 H 0.425 -9.175 7.826 1.00 . A A . 1 HIS HE2 1 1 2 142 1 1 1 HIS N N 0.668 -8.745 2.286 1.00 . A A . 1 HIS N 1 1 2 143 1 1 1 HIS ND1 N 0.469 -9.995 4.854 1.00 . A A . 1 HIS ND1 1 1 2 144 1 1 1 HIS NE2 N 0.308 -9.250 6.855 1.00 . A A . 1 HIS NE2 1 1 2 145 1 1 1 HIS O O -0.158 -6.347 4.242 1.00 . A A . 1 HIS O 1 1 2 146 1 1 2 ARG C C -0.903 -3.333 1.652 1.00 . A A . 2 ARG C 1 1 2 147 1 1 2 ARG CA C 0.025 -4.259 2.428 1.00 . A A . 2 ARG CA 1 1 2 148 1 1 2 ARG CB C 1.485 -3.911 2.127 1.00 . A A . 2 ARG CB 1 1 2 149 1 1 2 ARG CD C 2.306 -2.756 4.204 1.00 . A A . 2 ARG CD 1 1 2 150 1 1 2 ARG CG C 2.395 -4.005 3.341 1.00 . A A . 2 ARG CG 1 1 2 151 1 1 2 ARG CZ C 2.142 -2.167 6.591 1.00 . A A . 2 ARG CZ 1 1 2 152 1 1 2 ARG H H -0.370 -5.911 1.165 1.00 . A A . 2 ARG H 1 1 2 153 1 1 2 ARG HA H -0.157 -4.126 3.484 1.00 . A A . 2 ARG HA 1 1 2 154 1 1 2 ARG HB2 H 1.856 -4.589 1.373 1.00 . A A . 2 ARG HB2 1 1 2 155 1 1 2 ARG HB3 H 1.532 -2.902 1.746 1.00 . A A . 2 ARG HB3 1 1 2 156 1 1 2 ARG HD2 H 3.201 -2.170 4.060 1.00 . A A . 2 ARG HD2 1 1 2 157 1 1 2 ARG HD3 H 1.446 -2.180 3.895 1.00 . A A . 2 ARG HD3 1 1 2 158 1 1 2 ARG HE H 2.107 -4.026 5.867 1.00 . A A . 2 ARG HE 1 1 2 159 1 1 2 ARG HG2 H 2.103 -4.860 3.932 1.00 . A A . 2 ARG HG2 1 1 2 160 1 1 2 ARG HG3 H 3.415 -4.128 3.006 1.00 . A A . 2 ARG HG3 1 1 2 161 1 1 2 ARG HH11 H 2.324 -0.582 5.347 1.00 . A A . 2 ARG HH11 1 1 2 162 1 1 2 ARG HH12 H 2.206 -0.194 7.031 1.00 . A A . 2 ARG HH12 1 1 2 163 1 1 2 ARG HH21 H 1.952 -3.518 8.082 1.00 . A A . 2 ARG HH21 1 1 2 164 1 1 2 ARG HH22 H 1.996 -1.861 8.584 1.00 . A A . 2 ARG HH22 1 1 2 165 1 1 2 ARG N N -0.240 -5.655 2.102 1.00 . A A . 2 ARG N 1 1 2 166 1 1 2 ARG NE N 2.175 -3.079 5.623 1.00 . A A . 2 ARG NE 1 1 2 167 1 1 2 ARG NH1 N 2.231 -0.875 6.299 1.00 . A A . 2 ARG NH1 1 1 2 168 1 1 2 ARG NH2 N 2.020 -2.547 7.856 1.00 . A A . 2 ARG NH2 1 1 2 169 1 1 2 ARG O O -1.705 -3.784 0.833 1.00 . A A . 2 ARG O 1 1 2 170 1 1 3 PHE C C -0.945 -0.516 -0.012 1.00 . A A . 3 PHE C 1 1 2 171 1 1 3 PHE CA C -1.624 -1.046 1.245 1.00 . A A . 3 PHE CA 1 1 2 172 1 1 3 PHE CB C -1.953 0.106 2.192 1.00 . A A . 3 PHE CB 1 1 2 173 1 1 3 PHE CD1 C -4.401 -0.477 2.045 1.00 . A A . 3 PHE CD1 1 1 2 174 1 1 3 PHE CD2 C -3.792 1.798 2.427 1.00 . A A . 3 PHE CD2 1 1 2 175 1 1 3 PHE CE1 C -5.738 -0.127 2.074 1.00 . A A . 3 PHE CE1 1 1 2 176 1 1 3 PHE CE2 C -5.128 2.153 2.457 1.00 . A A . 3 PHE CE2 1 1 2 177 1 1 3 PHE CG C -3.412 0.481 2.221 1.00 . A A . 3 PHE CG 1 1 2 178 1 1 3 PHE CZ C -6.101 1.189 2.280 1.00 . A A . 3 PHE CZ 1 1 2 179 1 1 3 PHE H H -0.136 -1.738 2.581 1.00 . A A . 3 PHE H 1 1 2 180 1 1 3 PHE HA H -2.537 -1.527 0.957 1.00 . A A . 3 PHE HA 1 1 2 181 1 1 3 PHE HB2 H -1.662 -0.169 3.199 1.00 . A A . 3 PHE HB2 1 1 2 182 1 1 3 PHE HB3 H -1.395 0.975 1.881 1.00 . A A . 3 PHE HB3 1 1 2 183 1 1 3 PHE HD1 H -4.119 -1.507 1.882 1.00 . A A . 3 PHE HD1 1 1 2 184 1 1 3 PHE HD2 H -3.033 2.553 2.565 1.00 . A A . 3 PHE HD2 1 1 2 185 1 1 3 PHE HE1 H -6.497 -0.882 1.936 1.00 . A A . 3 PHE HE1 1 1 2 186 1 1 3 PHE HE2 H -5.410 3.183 2.618 1.00 . A A . 3 PHE HE2 1 1 2 187 1 1 3 PHE HZ H -7.145 1.465 2.304 1.00 . A A . 3 PHE HZ 1 1 2 188 1 1 3 PHE N N -0.792 -2.036 1.917 1.00 . A A . 3 PHE N 1 1 2 189 1 1 3 PHE O O 0.229 -0.789 -0.261 1.00 . A A . 3 PHE O 1 1 2 190 1 1 4 LEU C C -0.432 2.103 -1.782 1.00 . A A . 4 LEU C 1 1 2 191 1 1 4 LEU CA C -1.184 0.802 -2.042 1.00 . A A . 4 LEU CA 1 1 2 192 1 1 4 LEU CB C -2.325 1.042 -3.028 1.00 . A A . 4 LEU CB 1 1 2 193 1 1 4 LEU CD1 C -4.418 0.028 -2.117 1.00 . A A . 4 LEU CD1 1 1 2 194 1 1 4 LEU CD2 C -3.895 -0.181 -4.554 1.00 . A A . 4 LEU CD2 1 1 2 195 1 1 4 LEU CG C -3.315 -0.115 -3.149 1.00 . A A . 4 LEU CG 1 1 2 196 1 1 4 LEU H H -2.628 0.412 -0.550 1.00 . A A . 4 LEU H 1 1 2 197 1 1 4 LEU HA H -0.506 0.084 -2.467 1.00 . A A . 4 LEU HA 1 1 2 198 1 1 4 LEU HB2 H -2.865 1.924 -2.716 1.00 . A A . 4 LEU HB2 1 1 2 199 1 1 4 LEU HB3 H -1.900 1.226 -4.003 1.00 . A A . 4 LEU HB3 1 1 2 200 1 1 4 LEU HD11 H -4.175 -0.573 -1.254 1.00 . A A . 4 LEU HD11 1 1 2 201 1 1 4 LEU HD12 H -5.353 -0.307 -2.539 1.00 . A A . 4 LEU HD12 1 1 2 202 1 1 4 LEU HD13 H -4.502 1.063 -1.823 1.00 . A A . 4 LEU HD13 1 1 2 203 1 1 4 LEU HD21 H -4.852 0.319 -4.572 1.00 . A A . 4 LEU HD21 1 1 2 204 1 1 4 LEU HD22 H -4.022 -1.213 -4.842 1.00 . A A . 4 LEU HD22 1 1 2 205 1 1 4 LEU HD23 H -3.221 0.306 -5.244 1.00 . A A . 4 LEU HD23 1 1 2 206 1 1 4 LEU HG H -2.799 -1.043 -2.951 1.00 . A A . 4 LEU HG 1 1 2 207 1 1 4 LEU N N -1.700 0.237 -0.803 1.00 . A A . 4 LEU N 1 1 2 208 1 1 4 LEU O O -0.669 2.779 -0.781 1.00 . A A . 4 LEU O 1 1 2 209 1 1 5 ARG C C 0.677 4.787 -3.414 1.00 . A A . 5 ARG C 1 1 2 210 1 1 5 ARG CA C 1.262 3.668 -2.559 1.00 . A A . 5 ARG CA 1 1 2 211 1 1 5 ARG CB C 2.715 3.409 -2.962 1.00 . A A . 5 ARG CB 1 1 2 212 1 1 5 ARG CD C 4.083 5.489 -3.305 1.00 . A A . 5 ARG CD 1 1 2 213 1 1 5 ARG CG C 3.701 4.381 -2.336 1.00 . A A . 5 ARG CG 1 1 2 214 1 1 5 ARG CZ C 6.049 6.503 -2.219 1.00 . A A . 5 ARG CZ 1 1 2 215 1 1 5 ARG H H 0.619 1.867 -3.466 1.00 . A A . 5 ARG H 1 1 2 216 1 1 5 ARG HA H 1.235 3.971 -1.523 1.00 . A A . 5 ARG HA 1 1 2 217 1 1 5 ARG HB2 H 2.988 2.405 -2.656 1.00 . A A . 5 ARG HB2 1 1 2 218 1 1 5 ARG HB3 H 2.797 3.488 -4.040 1.00 . A A . 5 ARG HB3 1 1 2 219 1 1 5 ARG HD2 H 4.723 5.076 -4.070 1.00 . A A . 5 ARG HD2 1 1 2 220 1 1 5 ARG HD3 H 3.184 5.878 -3.760 1.00 . A A . 5 ARG HD3 1 1 2 221 1 1 5 ARG HE H 4.295 7.416 -2.494 1.00 . A A . 5 ARG HE 1 1 2 222 1 1 5 ARG HG2 H 3.250 4.823 -1.460 1.00 . A A . 5 ARG HG2 1 1 2 223 1 1 5 ARG HG3 H 4.592 3.841 -2.051 1.00 . A A . 5 ARG HG3 1 1 2 224 1 1 5 ARG HH11 H 6.327 4.600 -2.846 1.00 . A A . 5 ARG HH11 1 1 2 225 1 1 5 ARG HH12 H 7.694 5.336 -2.080 1.00 . A A . 5 ARG HH12 1 1 2 226 1 1 5 ARG HH21 H 6.093 8.386 -1.486 1.00 . A A . 5 ARG HH21 1 1 2 227 1 1 5 ARG HH22 H 7.561 7.486 -1.307 1.00 . A A . 5 ARG HH22 1 1 2 228 1 1 5 ARG N N 0.475 2.448 -2.690 1.00 . A A . 5 ARG N 1 1 2 229 1 1 5 ARG NE N 4.788 6.581 -2.638 1.00 . A A . 5 ARG NE 1 1 2 230 1 1 5 ARG NH1 N 6.747 5.388 -2.396 1.00 . A A . 5 ARG NH1 1 1 2 231 1 1 5 ARG NH2 N 6.614 7.544 -1.622 1.00 . A A . 5 ARG NH2 1 1 2 232 1 1 5 ARG O O 0.137 4.541 -4.492 1.00 . A A . 5 ARG O 1 1 2 233 1 1 6 HIS C C 1.288 8.313 -3.649 1.00 . A A . 6 HIS C 1 1 2 234 1 1 6 HIS CA C 0.271 7.176 -3.644 1.00 . A A . 6 HIS CA 1 1 2 235 1 1 6 HIS CB C -1.039 7.651 -3.013 1.00 . A A . 6 HIS CB 1 1 2 236 1 1 6 HIS CD2 C -0.500 7.145 -0.527 1.00 . A A . 6 HIS CD2 1 1 2 237 1 1 6 HIS CE1 C -1.080 9.079 0.327 1.00 . A A . 6 HIS CE1 1 1 2 238 1 1 6 HIS CG C -0.929 7.927 -1.546 1.00 . A A . 6 HIS CG 1 1 2 239 1 1 6 HIS H H 1.230 6.151 -2.060 1.00 . A A . 6 HIS H 1 1 2 240 1 1 6 HIS HA H 0.081 6.875 -4.663 1.00 . A A . 6 HIS HA 1 1 2 241 1 1 6 HIS HB2 H -1.355 8.566 -3.500 1.00 . A A . 6 HIS HB2 1 1 2 242 1 1 6 HIS HB3 H -1.796 6.887 -3.154 1.00 . A A . 6 HIS HB3 1 1 2 243 1 1 6 HIS HD1 H -1.637 9.910 -1.458 1.00 . A A . 6 HIS HD1 1 1 2 244 1 1 6 HIS HD2 H -0.143 6.128 -0.606 1.00 . A A . 6 HIS HD2 1 1 2 245 1 1 6 HIS HE1 H -1.269 9.877 1.029 1.00 . A A . 6 HIS HE1 1 1 2 246 1 1 6 HIS HE2 H -0.284 7.609 1.510 1.00 . A A . 6 HIS HE2 1 1 2 247 1 1 6 HIS N N 0.789 6.018 -2.925 1.00 . A A . 6 HIS N 1 1 2 248 1 1 6 HIS ND1 N -1.286 9.132 -0.977 1.00 . A A . 6 HIS ND1 1 1 2 249 1 1 6 HIS NE2 N -0.604 7.884 0.625 1.00 . A A . 6 HIS NE2 1 1 2 250 1 1 6 HIS O O 2.117 8.361 -4.582 1.00 . A A . 6 HIS O 1 1 3 251 1 1 1 HIS C C -0.486 -6.604 2.647 1.00 . A A . 1 HIS C 1 1 3 252 1 1 1 HIS CA C -0.464 -7.983 1.995 1.00 . A A . 1 HIS CA 1 1 3 253 1 1 1 HIS CB C -1.892 -8.492 1.785 1.00 . A A . 1 HIS CB 1 1 3 254 1 1 1 HIS CD2 C -2.864 -9.013 -0.562 1.00 . A A . 1 HIS CD2 1 1 3 255 1 1 1 HIS CE1 C -1.760 -10.864 -0.963 1.00 . A A . 1 HIS CE1 1 1 3 256 1 1 1 HIS CG C -2.074 -9.255 0.510 1.00 . A A . 1 HIS CG 1 1 3 257 1 1 1 HIS H1 H 1.281 -8.733 2.785 1.00 . A A . 1 HIS H1 1 1 3 258 1 1 1 HIS H2 H 0.079 -9.913 2.455 1.00 . A A . 1 HIS H2 1 1 3 259 1 1 1 HIS H3 H -0.085 -8.873 3.811 1.00 . A A . 1 HIS H3 1 1 3 260 1 1 1 HIS HA H 0.032 -7.912 1.039 1.00 . A A . 1 HIS HA 1 1 3 261 1 1 1 HIS HB2 H -2.158 -9.144 2.603 1.00 . A A . 1 HIS HB2 1 1 3 262 1 1 1 HIS HB3 H -2.568 -7.649 1.769 1.00 . A A . 1 HIS HB3 1 1 3 263 1 1 1 HIS HD1 H -0.744 -10.861 0.813 1.00 . A A . 1 HIS HD1 1 1 3 264 1 1 1 HIS HD2 H -3.538 -8.177 -0.687 1.00 . A A . 1 HIS HD2 1 1 3 265 1 1 1 HIS HE1 H -1.393 -11.758 -1.444 1.00 . A A . 1 HIS HE1 1 1 3 266 1 1 1 HIS HE2 H -3.018 -10.070 -2.370 1.00 . A A . 1 HIS HE2 1 1 3 267 1 1 1 HIS N N 0.269 -8.964 2.837 1.00 . A A . 1 HIS N 1 1 3 268 1 1 1 HIS ND1 N -1.396 -10.422 0.228 1.00 . A A . 1 HIS ND1 1 1 3 269 1 1 1 HIS NE2 N -2.650 -10.027 -1.462 1.00 . A A . 1 HIS NE2 1 1 3 270 1 1 1 HIS O O -0.991 -6.440 3.758 1.00 . A A . 1 HIS O 1 1 3 271 1 1 2 ARG C C -0.775 -3.329 1.624 1.00 . A A . 2 ARG C 1 1 3 272 1 1 2 ARG CA C 0.107 -4.251 2.459 1.00 . A A . 2 ARG CA 1 1 3 273 1 1 2 ARG CB C 1.547 -3.732 2.466 1.00 . A A . 2 ARG CB 1 1 3 274 1 1 2 ARG CD C 3.612 -3.230 3.807 1.00 . A A . 2 ARG CD 1 1 3 275 1 1 2 ARG CG C 2.246 -3.898 3.805 1.00 . A A . 2 ARG CG 1 1 3 276 1 1 2 ARG CZ C 3.830 -2.357 6.100 1.00 . A A . 2 ARG CZ 1 1 3 277 1 1 2 ARG H H 0.449 -5.810 1.069 1.00 . A A . 2 ARG H 1 1 3 278 1 1 2 ARG HA H -0.266 -4.263 3.472 1.00 . A A . 2 ARG HA 1 1 3 279 1 1 2 ARG HB2 H 2.114 -4.268 1.720 1.00 . A A . 2 ARG HB2 1 1 3 280 1 1 2 ARG HB3 H 1.541 -2.681 2.215 1.00 . A A . 2 ARG HB3 1 1 3 281 1 1 2 ARG HD2 H 4.267 -3.778 3.145 1.00 . A A . 2 ARG HD2 1 1 3 282 1 1 2 ARG HD3 H 3.504 -2.217 3.447 1.00 . A A . 2 ARG HD3 1 1 3 283 1 1 2 ARG HE H 4.922 -3.840 5.333 1.00 . A A . 2 ARG HE 1 1 3 284 1 1 2 ARG HG2 H 1.638 -3.450 4.577 1.00 . A A . 2 ARG HG2 1 1 3 285 1 1 2 ARG HG3 H 2.370 -4.951 4.008 1.00 . A A . 2 ARG HG3 1 1 3 286 1 1 2 ARG HH11 H 2.413 -1.440 4.986 1.00 . A A . 2 ARG HH11 1 1 3 287 1 1 2 ARG HH12 H 2.586 -0.844 6.602 1.00 . A A . 2 ARG HH12 1 1 3 288 1 1 2 ARG HH21 H 5.151 -3.058 7.459 1.00 . A A . 2 ARG HH21 1 1 3 289 1 1 2 ARG HH22 H 4.141 -1.762 8.007 1.00 . A A . 2 ARG HH22 1 1 3 290 1 1 2 ARG N N 0.064 -5.616 1.949 1.00 . A A . 2 ARG N 1 1 3 291 1 1 2 ARG NE N 4.206 -3.199 5.141 1.00 . A A . 2 ARG NE 1 1 3 292 1 1 2 ARG NH1 N 2.863 -1.475 5.877 1.00 . A A . 2 ARG NH1 1 1 3 293 1 1 2 ARG NH2 N 4.422 -2.396 7.286 1.00 . A A . 2 ARG NH2 1 1 3 294 1 1 2 ARG O O -1.366 -3.751 0.630 1.00 . A A . 2 ARG O 1 1 3 295 1 1 3 PHE C C -0.929 -0.530 0.119 1.00 . A A . 3 PHE C 1 1 3 296 1 1 3 PHE CA C -1.672 -1.087 1.327 1.00 . A A . 3 PHE CA 1 1 3 297 1 1 3 PHE CB C -2.078 0.047 2.264 1.00 . A A . 3 PHE CB 1 1 3 298 1 1 3 PHE CD1 C -4.503 -0.580 1.990 1.00 . A A . 3 PHE CD1 1 1 3 299 1 1 3 PHE CD2 C -3.955 1.710 2.367 1.00 . A A . 3 PHE CD2 1 1 3 300 1 1 3 PHE CE1 C -5.845 -0.254 1.939 1.00 . A A . 3 PHE CE1 1 1 3 301 1 1 3 PHE CE2 C -5.296 2.042 2.316 1.00 . A A . 3 PHE CE2 1 1 3 302 1 1 3 PHE CG C -3.542 0.397 2.205 1.00 . A A . 3 PHE CG 1 1 3 303 1 1 3 PHE CZ C -6.242 1.059 2.102 1.00 . A A . 3 PHE CZ 1 1 3 304 1 1 3 PHE H H -0.367 -1.792 2.836 1.00 . A A . 3 PHE H 1 1 3 305 1 1 3 PHE HA H -2.557 -1.582 0.980 1.00 . A A . 3 PHE HA 1 1 3 306 1 1 3 PHE HB2 H -1.846 -0.236 3.284 1.00 . A A . 3 PHE HB2 1 1 3 307 1 1 3 PHE HB3 H -1.517 0.929 1.998 1.00 . A A . 3 PHE HB3 1 1 3 308 1 1 3 PHE HD1 H -4.195 -1.608 1.862 1.00 . A A . 3 PHE HD1 1 1 3 309 1 1 3 PHE HD2 H -3.217 2.481 2.535 1.00 . A A . 3 PHE HD2 1 1 3 310 1 1 3 PHE HE1 H -6.583 -1.025 1.771 1.00 . A A . 3 PHE HE1 1 1 3 311 1 1 3 PHE HE2 H -5.604 3.069 2.444 1.00 . A A . 3 PHE HE2 1 1 3 312 1 1 3 PHE HZ H -7.290 1.316 2.062 1.00 . A A . 3 PHE HZ 1 1 3 313 1 1 3 PHE N N -0.860 -2.069 2.036 1.00 . A A . 3 PHE N 1 1 3 314 1 1 3 PHE O O 0.264 -0.776 -0.060 1.00 . A A . 3 PHE O 1 1 3 315 1 1 4 LEU C C -0.513 2.198 -1.625 1.00 . A A . 4 LEU C 1 1 3 316 1 1 4 LEU CA C -1.067 0.805 -1.909 1.00 . A A . 4 LEU CA 1 1 3 317 1 1 4 LEU CB C -2.108 0.871 -3.025 1.00 . A A . 4 LEU CB 1 1 3 318 1 1 4 LEU CD1 C -4.188 -0.241 -2.207 1.00 . A A . 4 LEU CD1 1 1 3 319 1 1 4 LEU CD2 C -3.452 -0.572 -4.574 1.00 . A A . 4 LEU CD2 1 1 3 320 1 1 4 LEU CG C -2.997 -0.365 -3.136 1.00 . A A . 4 LEU CG 1 1 3 321 1 1 4 LEU H H -2.594 0.371 -0.515 1.00 . A A . 4 LEU H 1 1 3 322 1 1 4 LEU HA H -0.262 0.166 -2.226 1.00 . A A . 4 LEU HA 1 1 3 323 1 1 4 LEU HB2 H -2.738 1.732 -2.852 1.00 . A A . 4 LEU HB2 1 1 3 324 1 1 4 LEU HB3 H -1.593 1.003 -3.964 1.00 . A A . 4 LEU HB3 1 1 3 325 1 1 4 LEU HD11 H -3.981 -0.777 -1.293 1.00 . A A . 4 LEU HD11 1 1 3 326 1 1 4 LEU HD12 H -5.064 -0.657 -2.681 1.00 . A A . 4 LEU HD12 1 1 3 327 1 1 4 LEU HD13 H -4.358 0.801 -1.981 1.00 . A A . 4 LEU HD13 1 1 3 328 1 1 4 LEU HD21 H -4.041 0.276 -4.890 1.00 . A A . 4 LEU HD21 1 1 3 329 1 1 4 LEU HD22 H -4.049 -1.469 -4.637 1.00 . A A . 4 LEU HD22 1 1 3 330 1 1 4 LEU HD23 H -2.588 -0.669 -5.214 1.00 . A A . 4 LEU HD23 1 1 3 331 1 1 4 LEU HG H -2.432 -1.234 -2.832 1.00 . A A . 4 LEU HG 1 1 3 332 1 1 4 LEU N N -1.648 0.217 -0.711 1.00 . A A . 4 LEU N 1 1 3 333 1 1 4 LEU O O -1.038 2.925 -0.783 1.00 . A A . 4 LEU O 1 1 3 334 1 1 5 ARG C C 0.920 4.759 -3.372 1.00 . A A . 5 ARG C 1 1 3 335 1 1 5 ARG CA C 1.174 3.868 -2.161 1.00 . A A . 5 ARG CA 1 1 3 336 1 1 5 ARG CB C 2.679 3.712 -1.935 1.00 . A A . 5 ARG CB 1 1 3 337 1 1 5 ARG CD C 3.963 5.868 -2.067 1.00 . A A . 5 ARG CD 1 1 3 338 1 1 5 ARG CG C 3.296 4.856 -1.149 1.00 . A A . 5 ARG CG 1 1 3 339 1 1 5 ARG CZ C 5.098 7.440 -0.546 1.00 . A A . 5 ARG CZ 1 1 3 340 1 1 5 ARG H H 0.922 1.938 -2.993 1.00 . A A . 5 ARG H 1 1 3 341 1 1 5 ARG HA H 0.736 4.332 -1.289 1.00 . A A . 5 ARG HA 1 1 3 342 1 1 5 ARG HB2 H 2.856 2.792 -1.390 1.00 . A A . 5 ARG HB2 1 1 3 343 1 1 5 ARG HB3 H 3.172 3.657 -2.899 1.00 . A A . 5 ARG HB3 1 1 3 344 1 1 5 ARG HD2 H 4.934 5.491 -2.353 1.00 . A A . 5 ARG HD2 1 1 3 345 1 1 5 ARG HD3 H 3.352 5.992 -2.949 1.00 . A A . 5 ARG HD3 1 1 3 346 1 1 5 ARG HE H 3.490 7.873 -1.647 1.00 . A A . 5 ARG HE 1 1 3 347 1 1 5 ARG HG2 H 2.520 5.353 -0.586 1.00 . A A . 5 ARG HG2 1 1 3 348 1 1 5 ARG HG3 H 4.036 4.456 -0.471 1.00 . A A . 5 ARG HG3 1 1 3 349 1 1 5 ARG HH11 H 5.930 5.598 -0.621 1.00 . A A . 5 ARG HH11 1 1 3 350 1 1 5 ARG HH12 H 6.709 6.722 0.442 1.00 . A A . 5 ARG HH12 1 1 3 351 1 1 5 ARG HH21 H 4.513 9.352 -0.249 1.00 . A A . 5 ARG HH21 1 1 3 352 1 1 5 ARG HH22 H 5.904 8.853 0.654 1.00 . A A . 5 ARG HH22 1 1 3 353 1 1 5 ARG N N 0.550 2.562 -2.335 1.00 . A A . 5 ARG N 1 1 3 354 1 1 5 ARG NE N 4.131 7.167 -1.419 1.00 . A A . 5 ARG NE 1 1 3 355 1 1 5 ARG NH1 N 5.985 6.510 -0.215 1.00 . A A . 5 ARG NH1 1 1 3 356 1 1 5 ARG NH2 N 5.178 8.647 -0.003 1.00 . A A . 5 ARG NH2 1 1 3 357 1 1 5 ARG O O 0.957 4.299 -4.513 1.00 . A A . 5 ARG O 1 1 3 358 1 1 6 HIS C C 1.002 8.355 -3.858 1.00 . A A . 6 HIS C 1 1 3 359 1 1 6 HIS CA C 0.399 6.993 -4.186 1.00 . A A . 6 HIS CA 1 1 3 360 1 1 6 HIS CB C -1.106 7.131 -4.418 1.00 . A A . 6 HIS CB 1 1 3 361 1 1 6 HIS CD2 C -2.395 6.793 -2.192 1.00 . A A . 6 HIS CD2 1 1 3 362 1 1 6 HIS CE1 C -2.828 8.897 -1.750 1.00 . A A . 6 HIS CE1 1 1 3 363 1 1 6 HIS CG C -1.864 7.536 -3.192 1.00 . A A . 6 HIS CG 1 1 3 364 1 1 6 HIS H H 0.644 6.345 -2.186 1.00 . A A . 6 HIS H 1 1 3 365 1 1 6 HIS HA H 0.860 6.616 -5.086 1.00 . A A . 6 HIS HA 1 1 3 366 1 1 6 HIS HB2 H -1.279 7.883 -5.179 1.00 . A A . 6 HIS HB2 1 1 3 367 1 1 6 HIS HB3 H -1.500 6.179 -4.755 1.00 . A A . 6 HIS HB3 1 1 3 368 1 1 6 HIS HD1 H -1.900 9.631 -3.420 1.00 . A A . 6 HIS HD1 1 1 3 369 1 1 6 HIS HD2 H -2.359 5.716 -2.105 1.00 . A A . 6 HIS HD2 1 1 3 370 1 1 6 HIS HE1 H -3.188 9.792 -1.266 1.00 . A A . 6 HIS HE1 1 1 3 371 1 1 6 HIS HE2 H -3.530 7.405 -0.535 1.00 . A A . 6 HIS HE2 1 1 3 372 1 1 6 HIS N N 0.661 6.037 -3.116 1.00 . A A . 6 HIS N 1 1 3 373 1 1 6 HIS ND1 N -2.153 8.850 -2.885 1.00 . A A . 6 HIS ND1 1 1 3 374 1 1 6 HIS NE2 N -2.988 7.662 -1.310 1.00 . A A . 6 HIS NE2 1 1 3 375 1 1 6 HIS O O 0.527 8.995 -2.896 1.00 . A A . 6 HIS O 1 1 4 376 1 1 1 HIS C C 0.090 -6.515 3.256 1.00 . A A . 1 HIS C 1 1 4 377 1 1 1 HIS CA C 0.043 -7.979 2.833 1.00 . A A . 1 HIS CA 1 1 4 378 1 1 1 HIS CB C 1.459 -8.557 2.773 1.00 . A A . 1 HIS CB 1 1 4 379 1 1 1 HIS CD2 C 0.890 -11.083 2.931 1.00 . A A . 1 HIS CD2 1 1 4 380 1 1 1 HIS CE1 C 2.281 -11.624 4.537 1.00 . A A . 1 HIS CE1 1 1 4 381 1 1 1 HIS CG C 1.556 -9.959 3.289 1.00 . A A . 1 HIS CG 1 1 4 382 1 1 1 HIS H1 H 0.118 -7.864 0.780 1.00 . A A . 1 HIS H1 1 1 4 383 1 1 1 HIS H2 H -1.415 -7.502 1.462 1.00 . A A . 1 HIS H2 1 1 4 384 1 1 1 HIS H3 H -0.868 -9.127 1.389 1.00 . A A . 1 HIS H3 1 1 4 385 1 1 1 HIS HA H -0.538 -8.536 3.552 1.00 . A A . 1 HIS HA 1 1 4 386 1 1 1 HIS HB2 H 1.797 -8.558 1.747 1.00 . A A . 1 HIS HB2 1 1 4 387 1 1 1 HIS HB3 H 2.119 -7.938 3.364 1.00 . A A . 1 HIS HB3 1 1 4 388 1 1 1 HIS HD1 H 3.040 -9.738 4.768 1.00 . A A . 1 HIS HD1 1 1 4 389 1 1 1 HIS HD2 H 0.131 -11.162 2.166 1.00 . A A . 1 HIS HD2 1 1 4 390 1 1 1 HIS HE1 H 2.828 -12.192 5.275 1.00 . A A . 1 HIS HE1 1 1 4 391 1 1 1 HIS HE2 H 1.122 -13.049 3.632 1.00 . A A . 1 HIS HE2 1 1 4 392 1 1 1 HIS N N -0.587 -8.132 1.495 1.00 . A A . 1 HIS N 1 1 4 393 1 1 1 HIS ND1 N 2.419 -10.332 4.298 1.00 . A A . 1 HIS ND1 1 1 4 394 1 1 1 HIS NE2 N 1.360 -12.103 3.722 1.00 . A A . 1 HIS NE2 1 1 4 395 1 1 1 HIS O O 0.041 -6.200 4.446 1.00 . A A . 1 HIS O 1 1 4 396 1 1 2 ARG C C -0.748 -3.433 1.665 1.00 . A A . 2 ARG C 1 1 4 397 1 1 2 ARG CA C 0.237 -4.191 2.547 1.00 . A A . 2 ARG CA 1 1 4 398 1 1 2 ARG CB C 1.654 -3.660 2.323 1.00 . A A . 2 ARG CB 1 1 4 399 1 1 2 ARG CD C 3.322 -2.873 0.617 1.00 . A A . 2 ARG CD 1 1 4 400 1 1 2 ARG CG C 2.125 -3.772 0.883 1.00 . A A . 2 ARG CG 1 1 4 401 1 1 2 ARG CZ C 3.742 -0.527 -0.006 1.00 . A A . 2 ARG CZ 1 1 4 402 1 1 2 ARG H H 0.219 -5.935 1.347 1.00 . A A . 2 ARG H 1 1 4 403 1 1 2 ARG HA H -0.036 -4.040 3.580 1.00 . A A . 2 ARG HA 1 1 4 404 1 1 2 ARG HB2 H 1.686 -2.620 2.610 1.00 . A A . 2 ARG HB2 1 1 4 405 1 1 2 ARG HB3 H 2.337 -4.218 2.947 1.00 . A A . 2 ARG HB3 1 1 4 406 1 1 2 ARG HD2 H 3.859 -2.728 1.542 1.00 . A A . 2 ARG HD2 1 1 4 407 1 1 2 ARG HD3 H 3.967 -3.358 -0.101 1.00 . A A . 2 ARG HD3 1 1 4 408 1 1 2 ARG HE H 1.993 -1.467 -0.205 1.00 . A A . 2 ARG HE 1 1 4 409 1 1 2 ARG HG2 H 2.405 -4.796 0.684 1.00 . A A . 2 ARG HG2 1 1 4 410 1 1 2 ARG HG3 H 1.316 -3.484 0.227 1.00 . A A . 2 ARG HG3 1 1 4 411 1 1 2 ARG HH11 H 5.348 -1.492 0.756 1.00 . A A . 2 ARG HH11 1 1 4 412 1 1 2 ARG HH12 H 5.617 0.159 0.309 1.00 . A A . 2 ARG HH12 1 1 4 413 1 1 2 ARG HH21 H 2.346 0.704 -0.794 1.00 . A A . 2 ARG HH21 1 1 4 414 1 1 2 ARG HH22 H 3.914 1.407 -0.570 1.00 . A A . 2 ARG HH22 1 1 4 415 1 1 2 ARG N N 0.184 -5.623 2.276 1.00 . A A . 2 ARG N 1 1 4 416 1 1 2 ARG NE N 2.922 -1.570 0.091 1.00 . A A . 2 ARG NE 1 1 4 417 1 1 2 ARG NH1 N 5.006 -0.628 0.385 1.00 . A A . 2 ARG NH1 1 1 4 418 1 1 2 ARG NH2 N 3.297 0.622 -0.497 1.00 . A A . 2 ARG NH2 1 1 4 419 1 1 2 ARG O O -1.421 -4.023 0.819 1.00 . A A . 2 ARG O 1 1 4 420 1 1 3 PHE C C -1.009 -0.611 -0.061 1.00 . A A . 3 PHE C 1 1 4 421 1 1 3 PHE CA C -1.735 -1.285 1.095 1.00 . A A . 3 PHE CA 1 1 4 422 1 1 3 PHE CB C -2.390 -0.235 1.991 1.00 . A A . 3 PHE CB 1 1 4 423 1 1 3 PHE CD1 C -4.646 -1.259 1.521 1.00 . A A . 3 PHE CD1 1 1 4 424 1 1 3 PHE CD2 C -4.533 1.073 2.008 1.00 . A A . 3 PHE CD2 1 1 4 425 1 1 3 PHE CE1 C -6.018 -1.166 1.382 1.00 . A A . 3 PHE CE1 1 1 4 426 1 1 3 PHE CE2 C -5.904 1.171 1.869 1.00 . A A . 3 PHE CE2 1 1 4 427 1 1 3 PHE CG C -3.886 -0.141 1.835 1.00 . A A . 3 PHE CG 1 1 4 428 1 1 3 PHE CZ C -6.648 0.051 1.556 1.00 . A A . 3 PHE CZ 1 1 4 429 1 1 3 PHE H H -0.269 -1.711 2.560 1.00 . A A . 3 PHE H 1 1 4 430 1 1 3 PHE HA H -2.499 -1.918 0.690 1.00 . A A . 3 PHE HA 1 1 4 431 1 1 3 PHE HB2 H -2.180 -0.472 3.027 1.00 . A A . 3 PHE HB2 1 1 4 432 1 1 3 PHE HB3 H -1.972 0.730 1.749 1.00 . A A . 3 PHE HB3 1 1 4 433 1 1 3 PHE HD1 H -4.156 -2.212 1.382 1.00 . A A . 3 PHE HD1 1 1 4 434 1 1 3 PHE HD2 H -3.953 1.951 2.252 1.00 . A A . 3 PHE HD2 1 1 4 435 1 1 3 PHE HE1 H -6.597 -2.044 1.136 1.00 . A A . 3 PHE HE1 1 1 4 436 1 1 3 PHE HE2 H -6.394 2.124 2.006 1.00 . A A . 3 PHE HE2 1 1 4 437 1 1 3 PHE HZ H -7.720 0.125 1.448 1.00 . A A . 3 PHE HZ 1 1 4 438 1 1 3 PHE N N -0.830 -2.123 1.870 1.00 . A A . 3 PHE N 1 1 4 439 1 1 3 PHE O O 0.217 -0.661 -0.155 1.00 . A A . 3 PHE O 1 1 4 440 1 1 4 LEU C C -0.695 2.072 -1.733 1.00 . A A . 4 LEU C 1 1 4 441 1 1 4 LEU CA C -1.222 0.690 -2.105 1.00 . A A . 4 LEU CA 1 1 4 442 1 1 4 LEU CB C -2.274 0.807 -3.206 1.00 . A A . 4 LEU CB 1 1 4 443 1 1 4 LEU CD1 C -4.271 -0.566 -2.597 1.00 . A A . 4 LEU CD1 1 1 4 444 1 1 4 LEU CD2 C -3.438 -0.562 -4.955 1.00 . A A . 4 LEU CD2 1 1 4 445 1 1 4 LEU CG C -3.046 -0.481 -3.487 1.00 . A A . 4 LEU CG 1 1 4 446 1 1 4 LEU H H -2.750 0.010 -0.814 1.00 . A A . 4 LEU H 1 1 4 447 1 1 4 LEU HA H -0.406 0.090 -2.470 1.00 . A A . 4 LEU HA 1 1 4 448 1 1 4 LEU HB2 H -2.980 1.574 -2.922 1.00 . A A . 4 LEU HB2 1 1 4 449 1 1 4 LEU HB3 H -1.782 1.112 -4.117 1.00 . A A . 4 LEU HB3 1 1 4 450 1 1 4 LEU HD11 H -5.084 -1.022 -3.142 1.00 . A A . 4 LEU HD11 1 1 4 451 1 1 4 LEU HD12 H -4.555 0.427 -2.285 1.00 . A A . 4 LEU HD12 1 1 4 452 1 1 4 LEU HD13 H -4.038 -1.163 -1.729 1.00 . A A . 4 LEU HD13 1 1 4 453 1 1 4 LEU HD21 H -2.695 -1.130 -5.496 1.00 . A A . 4 LEU HD21 1 1 4 454 1 1 4 LEU HD22 H -3.500 0.435 -5.367 1.00 . A A . 4 LEU HD22 1 1 4 455 1 1 4 LEU HD23 H -4.399 -1.048 -5.045 1.00 . A A . 4 LEU HD23 1 1 4 456 1 1 4 LEU HG H -2.415 -1.328 -3.259 1.00 . A A . 4 LEU HG 1 1 4 457 1 1 4 LEU N N -1.781 0.011 -0.945 1.00 . A A . 4 LEU N 1 1 4 458 1 1 4 LEU O O -1.248 2.745 -0.864 1.00 . A A . 4 LEU O 1 1 4 459 1 1 5 ARG C C 0.659 4.774 -3.255 1.00 . A A . 5 ARG C 1 1 4 460 1 1 5 ARG CA C 0.982 3.790 -2.135 1.00 . A A . 5 ARG CA 1 1 4 461 1 1 5 ARG CB C 2.498 3.651 -1.984 1.00 . A A . 5 ARG CB 1 1 4 462 1 1 5 ARG CD C 3.771 5.817 -2.036 1.00 . A A . 5 ARG CD 1 1 4 463 1 1 5 ARG CG C 3.129 4.758 -1.155 1.00 . A A . 5 ARG CG 1 1 4 464 1 1 5 ARG CZ C 6.188 5.395 -1.803 1.00 . A A . 5 ARG CZ 1 1 4 465 1 1 5 ARG H H 0.775 1.906 -3.078 1.00 . A A . 5 ARG H 1 1 4 466 1 1 5 ARG HA H 0.570 4.166 -1.211 1.00 . A A . 5 ARG HA 1 1 4 467 1 1 5 ARG HB2 H 2.716 2.704 -1.505 1.00 . A A . 5 ARG HB2 1 1 4 468 1 1 5 ARG HB3 H 2.949 3.665 -2.970 1.00 . A A . 5 ARG HB3 1 1 4 469 1 1 5 ARG HD2 H 3.120 6.010 -2.876 1.00 . A A . 5 ARG HD2 1 1 4 470 1 1 5 ARG HD3 H 3.891 6.722 -1.460 1.00 . A A . 5 ARG HD3 1 1 4 471 1 1 5 ARG HE H 5.130 5.099 -3.470 1.00 . A A . 5 ARG HE 1 1 4 472 1 1 5 ARG HG2 H 2.365 5.222 -0.550 1.00 . A A . 5 ARG HG2 1 1 4 473 1 1 5 ARG HG3 H 3.886 4.328 -0.515 1.00 . A A . 5 ARG HG3 1 1 4 474 1 1 5 ARG HH11 H 5.293 6.092 -0.128 1.00 . A A . 5 ARG HH11 1 1 4 475 1 1 5 ARG HH12 H 6.992 5.788 0.009 1.00 . A A . 5 ARG HH12 1 1 4 476 1 1 5 ARG HH21 H 7.365 4.698 -3.291 1.00 . A A . 5 ARG HH21 1 1 4 477 1 1 5 ARG HH22 H 8.169 4.997 -1.786 1.00 . A A . 5 ARG HH22 1 1 4 478 1 1 5 ARG N N 0.379 2.488 -2.397 1.00 . A A . 5 ARG N 1 1 4 479 1 1 5 ARG NE N 5.077 5.396 -2.537 1.00 . A A . 5 ARG NE 1 1 4 480 1 1 5 ARG NH1 N 6.155 5.791 -0.537 1.00 . A A . 5 ARG NH1 1 1 4 481 1 1 5 ARG NH2 N 7.334 4.997 -2.337 1.00 . A A . 5 ARG NH2 1 1 4 482 1 1 5 ARG O O 0.310 4.374 -4.366 1.00 . A A . 5 ARG O 1 1 4 483 1 1 6 HIS C C 1.485 8.262 -3.796 1.00 . A A . 6 HIS C 1 1 4 484 1 1 6 HIS CA C 0.500 7.106 -3.936 1.00 . A A . 6 HIS CA 1 1 4 485 1 1 6 HIS CB C -0.932 7.618 -3.775 1.00 . A A . 6 HIS CB 1 1 4 486 1 1 6 HIS CD2 C -2.002 7.884 -1.426 1.00 . A A . 6 HIS CD2 1 1 4 487 1 1 6 HIS CE1 C -1.005 9.742 -0.829 1.00 . A A . 6 HIS CE1 1 1 4 488 1 1 6 HIS CG C -1.192 8.256 -2.446 1.00 . A A . 6 HIS CG 1 1 4 489 1 1 6 HIS H H 1.061 6.320 -2.052 1.00 . A A . 6 HIS H 1 1 4 490 1 1 6 HIS HA H 0.610 6.673 -4.919 1.00 . A A . 6 HIS HA 1 1 4 491 1 1 6 HIS HB2 H -1.132 8.356 -4.542 1.00 . A A . 6 HIS HB2 1 1 4 492 1 1 6 HIS HB3 H -1.619 6.786 -3.886 1.00 . A A . 6 HIS HB3 1 1 4 493 1 1 6 HIS HD1 H 0.066 9.944 -2.561 1.00 . A A . 6 HIS HD1 1 1 4 494 1 1 6 HIS HD2 H -2.637 7.009 -1.399 1.00 . A A . 6 HIS HD2 1 1 4 495 1 1 6 HIS HE1 H -0.698 10.607 -0.259 1.00 . A A . 6 HIS HE1 1 1 4 496 1 1 6 HIS HE2 H -2.267 8.771 0.458 1.00 . A A . 6 HIS HE2 1 1 4 497 1 1 6 HIS N N 0.779 6.063 -2.955 1.00 . A A . 6 HIS N 1 1 4 498 1 1 6 HIS ND1 N -0.582 9.425 -2.040 1.00 . A A . 6 HIS ND1 1 1 4 499 1 1 6 HIS NE2 N -1.867 8.824 -0.435 1.00 . A A . 6 HIS NE2 1 1 4 500 1 1 6 HIS O O 1.571 9.082 -4.734 1.00 . A A . 6 HIS O 1 1 5 501 1 1 1 HIS C C 0.565 -6.218 2.925 1.00 . A A . 1 HIS C 1 1 5 502 1 1 1 HIS CA C 0.737 -7.641 2.403 1.00 . A A . 1 HIS CA 1 1 5 503 1 1 1 HIS CB C 2.049 -7.763 1.626 1.00 . A A . 1 HIS CB 1 1 5 504 1 1 1 HIS CD2 C 3.262 -8.663 3.735 1.00 . A A . 1 HIS CD2 1 1 5 505 1 1 1 HIS CE1 C 5.326 -8.495 3.014 1.00 . A A . 1 HIS CE1 1 1 5 506 1 1 1 HIS CG C 3.214 -8.164 2.477 1.00 . A A . 1 HIS CG 1 1 5 507 1 1 1 HIS H1 H -0.096 -8.877 0.985 1.00 . A A . 1 HIS H1 1 1 5 508 1 1 1 HIS H2 H -0.553 -7.228 0.855 1.00 . A A . 1 HIS H2 1 1 5 509 1 1 1 HIS H3 H -1.216 -8.208 2.097 1.00 . A A . 1 HIS H3 1 1 5 510 1 1 1 HIS HA H 0.755 -8.323 3.240 1.00 . A A . 1 HIS HA 1 1 5 511 1 1 1 HIS HB2 H 1.933 -8.506 0.851 1.00 . A A . 1 HIS HB2 1 1 5 512 1 1 1 HIS HB3 H 2.280 -6.810 1.172 1.00 . A A . 1 HIS HB3 1 1 5 513 1 1 1 HIS HD1 H 4.820 -7.743 1.179 1.00 . A A . 1 HIS HD1 1 1 5 514 1 1 1 HIS HD2 H 2.416 -8.868 4.376 1.00 . A A . 1 HIS HD2 1 1 5 515 1 1 1 HIS HE1 H 6.404 -8.535 2.965 1.00 . A A . 1 HIS HE1 1 1 5 516 1 1 1 HIS HE2 H 4.931 -9.129 4.921 1.00 . A A . 1 HIS HE2 1 1 5 517 1 1 1 HIS N N -0.383 -8.023 1.504 1.00 . A A . 1 HIS N 1 1 5 518 1 1 1 HIS ND1 N 4.523 -8.070 2.054 1.00 . A A . 1 HIS ND1 1 1 5 519 1 1 1 HIS NE2 N 4.585 -8.859 4.044 1.00 . A A . 1 HIS NE2 1 1 5 520 1 1 1 HIS O O 0.416 -6.001 4.127 1.00 . A A . 1 HIS O 1 1 5 521 1 1 2 ARG C C -0.644 -3.180 1.532 1.00 . A A . 2 ARG C 1 1 5 522 1 1 2 ARG CA C 0.431 -3.849 2.380 1.00 . A A . 2 ARG CA 1 1 5 523 1 1 2 ARG CB C 1.760 -3.108 2.219 1.00 . A A . 2 ARG CB 1 1 5 524 1 1 2 ARG CD C 3.418 -1.572 3.316 1.00 . A A . 2 ARG CD 1 1 5 525 1 1 2 ARG CG C 1.960 -1.990 3.229 1.00 . A A . 2 ARG CG 1 1 5 526 1 1 2 ARG CZ C 3.621 -0.441 5.496 1.00 . A A . 2 ARG CZ 1 1 5 527 1 1 2 ARG H H 0.708 -5.488 1.069 1.00 . A A . 2 ARG H 1 1 5 528 1 1 2 ARG HA H 0.130 -3.810 3.416 1.00 . A A . 2 ARG HA 1 1 5 529 1 1 2 ARG HB2 H 2.569 -3.815 2.332 1.00 . A A . 2 ARG HB2 1 1 5 530 1 1 2 ARG HB3 H 1.803 -2.682 1.228 1.00 . A A . 2 ARG HB3 1 1 5 531 1 1 2 ARG HD2 H 3.991 -2.392 3.725 1.00 . A A . 2 ARG HD2 1 1 5 532 1 1 2 ARG HD3 H 3.775 -1.345 2.322 1.00 . A A . 2 ARG HD3 1 1 5 533 1 1 2 ARG HE H 3.715 0.469 3.722 1.00 . A A . 2 ARG HE 1 1 5 534 1 1 2 ARG HG2 H 1.369 -1.137 2.928 1.00 . A A . 2 ARG HG2 1 1 5 535 1 1 2 ARG HG3 H 1.633 -2.332 4.200 1.00 . A A . 2 ARG HG3 1 1 5 536 1 1 2 ARG HH11 H 3.340 -2.440 5.613 1.00 . A A . 2 ARG HH11 1 1 5 537 1 1 2 ARG HH12 H 3.485 -1.621 7.132 1.00 . A A . 2 ARG HH12 1 1 5 538 1 1 2 ARG HH21 H 3.907 1.548 5.719 1.00 . A A . 2 ARG HH21 1 1 5 539 1 1 2 ARG HH22 H 3.807 0.643 7.192 1.00 . A A . 2 ARG HH22 1 1 5 540 1 1 2 ARG N N 0.586 -5.252 2.012 1.00 . A A . 2 ARG N 1 1 5 541 1 1 2 ARG NE N 3.601 -0.398 4.166 1.00 . A A . 2 ARG NE 1 1 5 542 1 1 2 ARG NH1 N 3.469 -1.596 6.132 1.00 . A A . 2 ARG NH1 1 1 5 543 1 1 2 ARG NH2 N 3.793 0.675 6.193 1.00 . A A . 2 ARG NH2 1 1 5 544 1 1 2 ARG O O -1.143 -3.764 0.570 1.00 . A A . 2 ARG O 1 1 5 545 1 1 3 PHE C C -1.426 -0.518 -0.055 1.00 . A A . 3 PHE C 1 1 5 546 1 1 3 PHE CA C -2.017 -1.204 1.171 1.00 . A A . 3 PHE CA 1 1 5 547 1 1 3 PHE CB C -2.677 -0.174 2.085 1.00 . A A . 3 PHE CB 1 1 5 548 1 1 3 PHE CD1 C -4.880 -1.375 1.845 1.00 . A A . 3 PHE CD1 1 1 5 549 1 1 3 PHE CD2 C -4.901 0.983 2.207 1.00 . A A . 3 PHE CD2 1 1 5 550 1 1 3 PHE CE1 C -6.262 -1.385 1.810 1.00 . A A . 3 PHE CE1 1 1 5 551 1 1 3 PHE CE2 C -6.283 0.978 2.172 1.00 . A A . 3 PHE CE2 1 1 5 552 1 1 3 PHE CG C -4.183 -0.191 2.043 1.00 . A A . 3 PHE CG 1 1 5 553 1 1 3 PHE CZ C -6.964 -0.207 1.974 1.00 . A A . 3 PHE CZ 1 1 5 554 1 1 3 PHE H H -0.566 -1.541 2.674 1.00 . A A . 3 PHE H 1 1 5 555 1 1 3 PHE HA H -2.762 -1.901 0.841 1.00 . A A . 3 PHE HA 1 1 5 556 1 1 3 PHE HB2 H -2.371 -0.361 3.107 1.00 . A A . 3 PHE HB2 1 1 5 557 1 1 3 PHE HB3 H -2.350 0.809 1.785 1.00 . A A . 3 PHE HB3 1 1 5 558 1 1 3 PHE HD1 H -4.333 -2.297 1.715 1.00 . A A . 3 PHE HD1 1 1 5 559 1 1 3 PHE HD2 H -4.371 1.910 2.362 1.00 . A A . 3 PHE HD2 1 1 5 560 1 1 3 PHE HE1 H -6.792 -2.313 1.654 1.00 . A A . 3 PHE HE1 1 1 5 561 1 1 3 PHE HE2 H -6.830 1.900 2.301 1.00 . A A . 3 PHE HE2 1 1 5 562 1 1 3 PHE HZ H -8.043 -0.213 1.947 1.00 . A A . 3 PHE HZ 1 1 5 563 1 1 3 PHE N N -0.998 -1.952 1.897 1.00 . A A . 3 PHE N 1 1 5 564 1 1 3 PHE O O -0.209 -0.484 -0.238 1.00 . A A . 3 PHE O 1 1 5 565 1 1 4 LEU C C -1.581 2.171 -1.845 1.00 . A A . 4 LEU C 1 1 5 566 1 1 4 LEU CA C -1.877 0.699 -2.111 1.00 . A A . 4 LEU CA 1 1 5 567 1 1 4 LEU CB C -2.948 0.565 -3.192 1.00 . A A . 4 LEU CB 1 1 5 568 1 1 4 LEU CD1 C -4.733 -0.966 -2.352 1.00 . A A . 4 LEU CD1 1 1 5 569 1 1 4 LEU CD2 C -3.997 -1.107 -4.738 1.00 . A A . 4 LEU CD2 1 1 5 570 1 1 4 LEU CG C -3.563 -0.828 -3.307 1.00 . A A . 4 LEU CG 1 1 5 571 1 1 4 LEU H H -3.257 -0.045 -0.694 1.00 . A A . 4 LEU H 1 1 5 572 1 1 4 LEU HA H -0.980 0.217 -2.454 1.00 . A A . 4 LEU HA 1 1 5 573 1 1 4 LEU HB2 H -3.738 1.271 -2.978 1.00 . A A . 4 LEU HB2 1 1 5 574 1 1 4 LEU HB3 H -2.506 0.820 -4.143 1.00 . A A . 4 LEU HB3 1 1 5 575 1 1 4 LEU HD11 H -5.510 -1.555 -2.815 1.00 . A A . 4 LEU HD11 1 1 5 576 1 1 4 LEU HD12 H -5.116 0.014 -2.111 1.00 . A A . 4 LEU HD12 1 1 5 577 1 1 4 LEU HD13 H -4.398 -1.454 -1.449 1.00 . A A . 4 LEU HD13 1 1 5 578 1 1 4 LEU HD21 H -4.403 -2.105 -4.803 1.00 . A A . 4 LEU HD21 1 1 5 579 1 1 4 LEU HD22 H -3.144 -1.022 -5.395 1.00 . A A . 4 LEU HD22 1 1 5 580 1 1 4 LEU HD23 H -4.751 -0.391 -5.032 1.00 . A A . 4 LEU HD23 1 1 5 581 1 1 4 LEU HG H -2.823 -1.564 -3.027 1.00 . A A . 4 LEU HG 1 1 5 582 1 1 4 LEU N N -2.302 0.020 -0.896 1.00 . A A . 4 LEU N 1 1 5 583 1 1 4 LEU O O -2.492 2.967 -1.616 1.00 . A A . 4 LEU O 1 1 5 584 1 1 5 ARG C C 0.893 4.451 -2.833 1.00 . A A . 5 ARG C 1 1 5 585 1 1 5 ARG CA C 0.117 3.904 -1.639 1.00 . A A . 5 ARG CA 1 1 5 586 1 1 5 ARG CB C 0.973 3.988 -0.374 1.00 . A A . 5 ARG CB 1 1 5 587 1 1 5 ARG CD C 1.548 6.338 0.310 1.00 . A A . 5 ARG CD 1 1 5 588 1 1 5 ARG CG C 0.613 5.159 0.526 1.00 . A A . 5 ARG CG 1 1 5 589 1 1 5 ARG CZ C 0.277 8.179 1.344 1.00 . A A . 5 ARG CZ 1 1 5 590 1 1 5 ARG H H 0.380 1.847 -2.064 1.00 . A A . 5 ARG H 1 1 5 591 1 1 5 ARG HA H -0.773 4.500 -1.500 1.00 . A A . 5 ARG HA 1 1 5 592 1 1 5 ARG HB2 H 0.846 3.073 0.194 1.00 . A A . 5 ARG HB2 1 1 5 593 1 1 5 ARG HB3 H 2.014 4.088 -0.661 1.00 . A A . 5 ARG HB3 1 1 5 594 1 1 5 ARG HD2 H 2.265 6.364 1.117 1.00 . A A . 5 ARG HD2 1 1 5 595 1 1 5 ARG HD3 H 2.068 6.203 -0.627 1.00 . A A . 5 ARG HD3 1 1 5 596 1 1 5 ARG HE H 0.751 8.061 -0.591 1.00 . A A . 5 ARG HE 1 1 5 597 1 1 5 ARG HG2 H -0.398 5.470 0.307 1.00 . A A . 5 ARG HG2 1 1 5 598 1 1 5 ARG HG3 H 0.679 4.842 1.556 1.00 . A A . 5 ARG HG3 1 1 5 599 1 1 5 ARG HH11 H 0.842 6.724 2.631 1.00 . A A . 5 ARG HH11 1 1 5 600 1 1 5 ARG HH12 H -0.053 8.029 3.333 1.00 . A A . 5 ARG HH12 1 1 5 601 1 1 5 ARG HH21 H -0.427 9.779 0.330 1.00 . A A . 5 ARG HH21 1 1 5 602 1 1 5 ARG HH22 H -0.774 9.764 2.027 1.00 . A A . 5 ARG HH22 1 1 5 603 1 1 5 ARG N N -0.301 2.527 -1.877 1.00 . A A . 5 ARG N 1 1 5 604 1 1 5 ARG NE N 0.828 7.609 0.275 1.00 . A A . 5 ARG NE 1 1 5 605 1 1 5 ARG NH1 N 0.362 7.596 2.534 1.00 . A A . 5 ARG NH1 1 1 5 606 1 1 5 ARG NH2 N -0.360 9.335 1.224 1.00 . A A . 5 ARG NH2 1 1 5 607 1 1 5 ARG O O 1.564 3.704 -3.544 1.00 . A A . 5 ARG O 1 1 5 608 1 1 6 HIS C C 2.645 7.263 -3.647 1.00 . A A . 6 HIS C 1 1 5 609 1 1 6 HIS CA C 1.489 6.407 -4.154 1.00 . A A . 6 HIS CA 1 1 5 610 1 1 6 HIS CB C 0.515 7.269 -4.958 1.00 . A A . 6 HIS CB 1 1 5 611 1 1 6 HIS CD2 C 0.012 8.852 -2.965 1.00 . A A . 6 HIS CD2 1 1 5 612 1 1 6 HIS CE1 C -2.050 9.381 -3.489 1.00 . A A . 6 HIS CE1 1 1 5 613 1 1 6 HIS CG C -0.297 8.199 -4.111 1.00 . A A . 6 HIS CG 1 1 5 614 1 1 6 HIS H H 0.246 6.302 -2.444 1.00 . A A . 6 HIS H 1 1 5 615 1 1 6 HIS HA H 1.884 5.633 -4.795 1.00 . A A . 6 HIS HA 1 1 5 616 1 1 6 HIS HB2 H 1.075 7.869 -5.666 1.00 . A A . 6 HIS HB2 1 1 5 617 1 1 6 HIS HB3 H -0.170 6.622 -5.495 1.00 . A A . 6 HIS HB3 1 1 5 618 1 1 6 HIS HD1 H -2.108 8.241 -5.188 1.00 . A A . 6 HIS HD1 1 1 5 619 1 1 6 HIS HD2 H 0.954 8.808 -2.436 1.00 . A A . 6 HIS HD2 1 1 5 620 1 1 6 HIS HE1 H -3.036 9.821 -3.466 1.00 . A A . 6 HIS HE1 1 1 5 621 1 1 6 HIS HE2 H -1.196 10.080 -1.765 1.00 . A A . 6 HIS HE2 1 1 5 622 1 1 6 HIS N N 0.796 5.759 -3.046 1.00 . A A . 6 HIS N 1 1 5 623 1 1 6 HIS ND1 N -1.596 8.552 -4.412 1.00 . A A . 6 HIS ND1 1 1 5 624 1 1 6 HIS NE2 N -1.095 9.578 -2.600 1.00 . A A . 6 HIS NE2 1 1 5 625 1 1 6 HIS O O 3.336 7.880 -4.485 1.00 . A A . 6 HIS O 1 1 6 626 1 1 1 HIS C C -0.462 -6.551 2.641 1.00 . A A . 1 HIS C 1 1 6 627 1 1 1 HIS CA C -0.432 -7.977 2.101 1.00 . A A . 1 HIS CA 1 1 6 628 1 1 1 HIS CB C -1.741 -8.298 1.375 1.00 . A A . 1 HIS CB 1 1 6 629 1 1 1 HIS CD2 C -1.915 -7.560 -1.106 1.00 . A A . 1 HIS CD2 1 1 6 630 1 1 1 HIS CE1 C -1.036 -9.342 -2.032 1.00 . A A . 1 HIS CE1 1 1 6 631 1 1 1 HIS CG C -1.588 -8.417 -0.109 1.00 . A A . 1 HIS CG 1 1 6 632 1 1 1 HIS H1 H 0.514 -8.612 3.815 1.00 . A A . 1 HIS H1 1 1 6 633 1 1 1 HIS H2 H 0.012 -9.873 2.765 1.00 . A A . 1 HIS H2 1 1 6 634 1 1 1 HIS H3 H -1.145 -9.034 3.716 1.00 . A A . 1 HIS H3 1 1 6 635 1 1 1 HIS HA H 0.391 -8.074 1.409 1.00 . A A . 1 HIS HA 1 1 6 636 1 1 1 HIS HB2 H -2.128 -9.236 1.744 1.00 . A A . 1 HIS HB2 1 1 6 637 1 1 1 HIS HB3 H -2.458 -7.515 1.575 1.00 . A A . 1 HIS HB3 1 1 6 638 1 1 1 HIS HD1 H -0.703 -10.323 -0.268 1.00 . A A . 1 HIS HD1 1 1 6 639 1 1 1 HIS HD2 H -2.369 -6.586 -0.990 1.00 . A A . 1 HIS HD2 1 1 6 640 1 1 1 HIS HE1 H -0.667 -10.043 -2.767 1.00 . A A . 1 HIS HE1 1 1 6 641 1 1 1 HIS HE2 H -1.760 -7.811 -3.184 1.00 . A A . 1 HIS HE2 1 1 6 642 1 1 1 HIS N N -0.246 -8.963 3.198 1.00 . A A . 1 HIS N 1 1 6 643 1 1 1 HIS ND1 N -1.040 -9.524 -0.724 1.00 . A A . 1 HIS ND1 1 1 6 644 1 1 1 HIS NE2 N -1.562 -8.159 -2.290 1.00 . A A . 1 HIS NE2 1 1 6 645 1 1 1 HIS O O -1.124 -6.269 3.640 1.00 . A A . 1 HIS O 1 1 6 646 1 1 2 ARG C C -0.638 -3.407 1.554 1.00 . A A . 2 ARG C 1 1 6 647 1 1 2 ARG CA C 0.314 -4.258 2.387 1.00 . A A . 2 ARG CA 1 1 6 648 1 1 2 ARG CB C 1.741 -3.722 2.259 1.00 . A A . 2 ARG CB 1 1 6 649 1 1 2 ARG CD C 2.621 -4.829 4.339 1.00 . A A . 2 ARG CD 1 1 6 650 1 1 2 ARG CG C 2.795 -4.652 2.839 1.00 . A A . 2 ARG CG 1 1 6 651 1 1 2 ARG CZ C 4.363 -3.406 5.346 1.00 . A A . 2 ARG CZ 1 1 6 652 1 1 2 ARG H H 0.765 -5.941 1.185 1.00 . A A . 2 ARG H 1 1 6 653 1 1 2 ARG HA H 0.011 -4.206 3.422 1.00 . A A . 2 ARG HA 1 1 6 654 1 1 2 ARG HB2 H 1.964 -3.569 1.213 1.00 . A A . 2 ARG HB2 1 1 6 655 1 1 2 ARG HB3 H 1.805 -2.775 2.774 1.00 . A A . 2 ARG HB3 1 1 6 656 1 1 2 ARG HD2 H 1.884 -4.122 4.691 1.00 . A A . 2 ARG HD2 1 1 6 657 1 1 2 ARG HD3 H 2.274 -5.834 4.532 1.00 . A A . 2 ARG HD3 1 1 6 658 1 1 2 ARG HE H 4.367 -5.402 5.359 1.00 . A A . 2 ARG HE 1 1 6 659 1 1 2 ARG HG2 H 2.713 -5.616 2.361 1.00 . A A . 2 ARG HG2 1 1 6 660 1 1 2 ARG HG3 H 3.773 -4.235 2.646 1.00 . A A . 2 ARG HG3 1 1 6 661 1 1 2 ARG HH11 H 2.858 -2.386 4.459 1.00 . A A . 2 ARG HH11 1 1 6 662 1 1 2 ARG HH12 H 4.095 -1.410 5.177 1.00 . A A . 2 ARG HH12 1 1 6 663 1 1 2 ARG HH21 H 5.994 -4.119 6.304 1.00 . A A . 2 ARG HH21 1 1 6 664 1 1 2 ARG HH22 H 5.875 -2.393 6.224 1.00 . A A . 2 ARG HH22 1 1 6 665 1 1 2 ARG N N 0.259 -5.656 1.974 1.00 . A A . 2 ARG N 1 1 6 666 1 1 2 ARG NE N 3.870 -4.610 5.065 1.00 . A A . 2 ARG NE 1 1 6 667 1 1 2 ARG NH1 N 3.719 -2.311 4.963 1.00 . A A . 2 ARG NH1 1 1 6 668 1 1 2 ARG NH2 N 5.504 -3.297 6.013 1.00 . A A . 2 ARG NH2 1 1 6 669 1 1 2 ARG O O -1.287 -3.903 0.634 1.00 . A A . 2 ARG O 1 1 6 670 1 1 3 PHE C C -0.869 -0.563 -0.010 1.00 . A A . 3 PHE C 1 1 6 671 1 1 3 PHE CA C -1.591 -1.203 1.169 1.00 . A A . 3 PHE CA 1 1 6 672 1 1 3 PHE CB C -2.117 -0.123 2.113 1.00 . A A . 3 PHE CB 1 1 6 673 1 1 3 PHE CD1 C -4.471 -0.948 1.752 1.00 . A A . 3 PHE CD1 1 1 6 674 1 1 3 PHE CD2 C -4.133 1.370 2.201 1.00 . A A . 3 PHE CD2 1 1 6 675 1 1 3 PHE CE1 C -5.834 -0.736 1.669 1.00 . A A . 3 PHE CE1 1 1 6 676 1 1 3 PHE CE2 C -5.496 1.587 2.119 1.00 . A A . 3 PHE CE2 1 1 6 677 1 1 3 PHE CG C -3.604 0.102 2.019 1.00 . A A . 3 PHE CG 1 1 6 678 1 1 3 PHE CZ C -6.347 0.533 1.853 1.00 . A A . 3 PHE CZ 1 1 6 679 1 1 3 PHE H H -0.175 -1.786 2.630 1.00 . A A . 3 PHE H 1 1 6 680 1 1 3 PHE HA H -2.421 -1.766 0.792 1.00 . A A . 3 PHE HA 1 1 6 681 1 1 3 PHE HB2 H -1.889 -0.403 3.134 1.00 . A A . 3 PHE HB2 1 1 6 682 1 1 3 PHE HB3 H -1.627 0.808 1.876 1.00 . A A . 3 PHE HB3 1 1 6 683 1 1 3 PHE HD1 H -4.073 -1.941 1.607 1.00 . A A . 3 PHE HD1 1 1 6 684 1 1 3 PHE HD2 H -3.469 2.196 2.410 1.00 . A A . 3 PHE HD2 1 1 6 685 1 1 3 PHE HE1 H -6.498 -1.562 1.460 1.00 . A A . 3 PHE HE1 1 1 6 686 1 1 3 PHE HE2 H -5.894 2.581 2.263 1.00 . A A . 3 PHE HE2 1 1 6 687 1 1 3 PHE HZ H -7.412 0.701 1.788 1.00 . A A . 3 PHE HZ 1 1 6 688 1 1 3 PHE N N -0.716 -2.123 1.885 1.00 . A A . 3 PHE N 1 1 6 689 1 1 3 PHE O O 0.344 -0.702 -0.163 1.00 . A A . 3 PHE O 1 1 6 690 1 1 4 LEU C C -0.586 2.196 -1.684 1.00 . A A . 4 LEU C 1 1 6 691 1 1 4 LEU CA C -1.075 0.791 -2.020 1.00 . A A . 4 LEU CA 1 1 6 692 1 1 4 LEU CB C -2.118 0.849 -3.135 1.00 . A A . 4 LEU CB 1 1 6 693 1 1 4 LEU CD1 C -4.127 -0.440 -2.401 1.00 . A A . 4 LEU CD1 1 1 6 694 1 1 4 LEU CD2 C -3.346 -0.600 -4.772 1.00 . A A . 4 LEU CD2 1 1 6 695 1 1 4 LEU CG C -2.921 -0.437 -3.320 1.00 . A A . 4 LEU CG 1 1 6 696 1 1 4 LEU H H -2.591 0.202 -0.671 1.00 . A A . 4 LEU H 1 1 6 697 1 1 4 LEU HA H -0.242 0.202 -2.358 1.00 . A A . 4 LEU HA 1 1 6 698 1 1 4 LEU HB2 H -2.805 1.654 -2.917 1.00 . A A . 4 LEU HB2 1 1 6 699 1 1 4 LEU HB3 H -1.612 1.069 -4.063 1.00 . A A . 4 LEU HB3 1 1 6 700 1 1 4 LEU HD11 H -4.967 -0.889 -2.907 1.00 . A A . 4 LEU HD11 1 1 6 701 1 1 4 LEU HD12 H -4.369 0.575 -2.125 1.00 . A A . 4 LEU HD12 1 1 6 702 1 1 4 LEU HD13 H -3.894 -1.007 -1.513 1.00 . A A . 4 LEU HD13 1 1 6 703 1 1 4 LEU HD21 H -2.526 -1.010 -5.343 1.00 . A A . 4 LEU HD21 1 1 6 704 1 1 4 LEU HD22 H -3.621 0.362 -5.177 1.00 . A A . 4 LEU HD22 1 1 6 705 1 1 4 LEU HD23 H -4.192 -1.269 -4.826 1.00 . A A . 4 LEU HD23 1 1 6 706 1 1 4 LEU HG H -2.301 -1.280 -3.052 1.00 . A A . 4 LEU HG 1 1 6 707 1 1 4 LEU N N -1.631 0.134 -0.846 1.00 . A A . 4 LEU N 1 1 6 708 1 1 4 LEU O O -1.172 2.885 -0.849 1.00 . A A . 4 LEU O 1 1 6 709 1 1 5 ARG C C 0.692 4.894 -3.239 1.00 . A A . 5 ARG C 1 1 6 710 1 1 5 ARG CA C 1.060 3.938 -2.109 1.00 . A A . 5 ARG CA 1 1 6 711 1 1 5 ARG CB C 2.581 3.846 -1.977 1.00 . A A . 5 ARG CB 1 1 6 712 1 1 5 ARG CD C 3.693 6.071 -1.614 1.00 . A A . 5 ARG CD 1 1 6 713 1 1 5 ARG CG C 3.160 4.810 -0.954 1.00 . A A . 5 ARG CG 1 1 6 714 1 1 5 ARG CZ C 3.871 7.702 0.225 1.00 . A A . 5 ARG CZ 1 1 6 715 1 1 5 ARG H H 0.915 2.020 -2.993 1.00 . A A . 5 ARG H 1 1 6 716 1 1 5 ARG HA H 0.650 4.318 -1.185 1.00 . A A . 5 ARG HA 1 1 6 717 1 1 5 ARG HB2 H 2.845 2.838 -1.680 1.00 . A A . 5 ARG HB2 1 1 6 718 1 1 5 ARG HB3 H 3.028 4.063 -2.940 1.00 . A A . 5 ARG HB3 1 1 6 719 1 1 5 ARG HD2 H 4.771 6.022 -1.638 1.00 . A A . 5 ARG HD2 1 1 6 720 1 1 5 ARG HD3 H 3.313 6.122 -2.624 1.00 . A A . 5 ARG HD3 1 1 6 721 1 1 5 ARG HE H 2.547 7.798 -1.265 1.00 . A A . 5 ARG HE 1 1 6 722 1 1 5 ARG HG2 H 2.385 5.083 -0.253 1.00 . A A . 5 ARG HG2 1 1 6 723 1 1 5 ARG HG3 H 3.967 4.320 -0.429 1.00 . A A . 5 ARG HG3 1 1 6 724 1 1 5 ARG HH11 H 5.208 6.187 0.316 1.00 . A A . 5 ARG HH11 1 1 6 725 1 1 5 ARG HH12 H 5.312 7.347 1.598 1.00 . A A . 5 ARG HH12 1 1 6 726 1 1 5 ARG HH21 H 2.682 9.325 0.419 1.00 . A A . 5 ARG HH21 1 1 6 727 1 1 5 ARG HH22 H 3.878 9.128 1.657 1.00 . A A . 5 ARG HH22 1 1 6 728 1 1 5 ARG N N 0.491 2.615 -2.339 1.00 . A A . 5 ARG N 1 1 6 729 1 1 5 ARG NE N 3.290 7.277 -0.895 1.00 . A A . 5 ARG NE 1 1 6 730 1 1 5 ARG NH1 N 4.879 7.022 0.757 1.00 . A A . 5 ARG NH1 1 1 6 731 1 1 5 ARG NH2 N 3.442 8.809 0.815 1.00 . A A . 5 ARG NH2 1 1 6 732 1 1 5 ARG O O 0.529 4.481 -4.387 1.00 . A A . 5 ARG O 1 1 6 733 1 1 6 HIS C C 1.388 8.130 -4.144 1.00 . A A . 6 HIS C 1 1 6 734 1 1 6 HIS CA C 0.213 7.190 -3.892 1.00 . A A . 6 HIS CA 1 1 6 735 1 1 6 HIS CB C -1.003 7.991 -3.422 1.00 . A A . 6 HIS CB 1 1 6 736 1 1 6 HIS CD2 C -1.417 8.445 -0.902 1.00 . A A . 6 HIS CD2 1 1 6 737 1 1 6 HIS CE1 C 0.058 10.041 -0.618 1.00 . A A . 6 HIS CE1 1 1 6 738 1 1 6 HIS CG C -0.807 8.651 -2.093 1.00 . A A . 6 HIS CG 1 1 6 739 1 1 6 HIS H H 0.704 6.442 -1.974 1.00 . A A . 6 HIS H 1 1 6 740 1 1 6 HIS HA H -0.033 6.686 -4.814 1.00 . A A . 6 HIS HA 1 1 6 741 1 1 6 HIS HB2 H -1.219 8.765 -4.149 1.00 . A A . 6 HIS HB2 1 1 6 742 1 1 6 HIS HB3 H -1.855 7.324 -3.342 1.00 . A A . 6 HIS HB3 1 1 6 743 1 1 6 HIS HD1 H 0.714 10.035 -2.556 1.00 . A A . 6 HIS HD1 1 1 6 744 1 1 6 HIS HD2 H -2.197 7.724 -0.697 1.00 . A A . 6 HIS HD2 1 1 6 745 1 1 6 HIS HE1 H 0.663 10.813 -0.165 1.00 . A A . 6 HIS HE1 1 1 6 746 1 1 6 HIS HE2 H -1.048 9.345 0.959 1.00 . A A . 6 HIS HE2 1 1 6 747 1 1 6 HIS N N 0.562 6.174 -2.905 1.00 . A A . 6 HIS N 1 1 6 748 1 1 6 HIS ND1 N 0.112 9.658 -1.881 1.00 . A A . 6 HIS ND1 1 1 6 749 1 1 6 HIS NE2 N -0.862 9.321 -0.003 1.00 . A A . 6 HIS NE2 1 1 6 750 1 1 6 HIS O O 1.283 8.975 -5.058 1.00 . A A . 6 HIS O 1 1 7 751 1 1 1 HIS C C -0.194 -6.657 2.899 1.00 . A A . 1 HIS C 1 1 7 752 1 1 1 HIS CA C -0.447 -8.104 2.490 1.00 . A A . 1 HIS CA 1 1 7 753 1 1 1 HIS CB C -1.815 -8.566 2.997 1.00 . A A . 1 HIS CB 1 1 7 754 1 1 1 HIS CD2 C -2.104 -10.400 1.185 1.00 . A A . 1 HIS CD2 1 1 7 755 1 1 1 HIS CE1 C -4.276 -10.252 0.925 1.00 . A A . 1 HIS CE1 1 1 7 756 1 1 1 HIS CG C -2.550 -9.437 2.027 1.00 . A A . 1 HIS CG 1 1 7 757 1 1 1 HIS H1 H 0.599 -8.890 4.077 1.00 . A A . 1 HIS H1 1 1 7 758 1 1 1 HIS H2 H 1.506 -8.734 2.629 1.00 . A A . 1 HIS H2 1 1 7 759 1 1 1 HIS H3 H 0.339 -9.983 2.782 1.00 . A A . 1 HIS H3 1 1 7 760 1 1 1 HIS HA H -0.425 -8.175 1.413 1.00 . A A . 1 HIS HA 1 1 7 761 1 1 1 HIS HB2 H -1.682 -9.126 3.910 1.00 . A A . 1 HIS HB2 1 1 7 762 1 1 1 HIS HB3 H -2.428 -7.699 3.199 1.00 . A A . 1 HIS HB3 1 1 7 763 1 1 1 HIS HD1 H -4.528 -8.763 2.305 1.00 . A A . 1 HIS HD1 1 1 7 764 1 1 1 HIS HD2 H -1.079 -10.722 1.066 1.00 . A A . 1 HIS HD2 1 1 7 765 1 1 1 HIS HE1 H -5.283 -10.423 0.574 1.00 . A A . 1 HIS HE1 1 1 7 766 1 1 1 HIS HE2 H -3.191 -11.655 -0.099 1.00 . A A . 1 HIS HE2 1 1 7 767 1 1 1 HIS N N 0.593 -9.009 3.045 1.00 . A A . 1 HIS N 1 1 7 768 1 1 1 HIS ND1 N -3.915 -9.368 1.838 1.00 . A A . 1 HIS ND1 1 1 7 769 1 1 1 HIS NE2 N -3.196 -10.890 0.513 1.00 . A A . 1 HIS NE2 1 1 7 770 1 1 1 HIS O O -0.195 -6.327 4.085 1.00 . A A . 1 HIS O 1 1 7 771 1 1 2 ARG C C -0.704 -3.506 1.395 1.00 . A A . 2 ARG C 1 1 7 772 1 1 2 ARG CA C 0.276 -4.384 2.166 1.00 . A A . 2 ARG CA 1 1 7 773 1 1 2 ARG CB C 1.714 -4.025 1.784 1.00 . A A . 2 ARG CB 1 1 7 774 1 1 2 ARG CD C 3.022 -5.383 3.445 1.00 . A A . 2 ARG CD 1 1 7 775 1 1 2 ARG CG C 2.666 -3.984 2.968 1.00 . A A . 2 ARG CG 1 1 7 776 1 1 2 ARG CZ C 5.193 -5.841 2.375 1.00 . A A . 2 ARG CZ 1 1 7 777 1 1 2 ARG H H 0.010 -6.119 0.984 1.00 . A A . 2 ARG H 1 1 7 778 1 1 2 ARG HA H 0.140 -4.209 3.223 1.00 . A A . 2 ARG HA 1 1 7 779 1 1 2 ARG HB2 H 2.081 -4.757 1.080 1.00 . A A . 2 ARG HB2 1 1 7 780 1 1 2 ARG HB3 H 1.719 -3.053 1.313 1.00 . A A . 2 ARG HB3 1 1 7 781 1 1 2 ARG HD2 H 3.529 -5.307 4.396 1.00 . A A . 2 ARG HD2 1 1 7 782 1 1 2 ARG HD3 H 2.110 -5.949 3.569 1.00 . A A . 2 ARG HD3 1 1 7 783 1 1 2 ARG HE H 3.480 -6.763 1.928 1.00 . A A . 2 ARG HE 1 1 7 784 1 1 2 ARG HG2 H 3.572 -3.475 2.672 1.00 . A A . 2 ARG HG2 1 1 7 785 1 1 2 ARG HG3 H 2.196 -3.445 3.777 1.00 . A A . 2 ARG HG3 1 1 7 786 1 1 2 ARG HH11 H 5.248 -4.407 3.800 1.00 . A A . 2 ARG HH11 1 1 7 787 1 1 2 ARG HH12 H 6.762 -4.749 3.033 1.00 . A A . 2 ARG HH12 1 1 7 788 1 1 2 ARG HH21 H 5.471 -7.215 0.918 1.00 . A A . 2 ARG HH21 1 1 7 789 1 1 2 ARG HH22 H 6.889 -6.342 1.396 1.00 . A A . 2 ARG HH22 1 1 7 790 1 1 2 ARG N N 0.022 -5.797 1.910 1.00 . A A . 2 ARG N 1 1 7 791 1 1 2 ARG NE N 3.890 -6.080 2.500 1.00 . A A . 2 ARG NE 1 1 7 792 1 1 2 ARG NH1 N 5.783 -4.924 3.131 1.00 . A A . 2 ARG NH1 1 1 7 793 1 1 2 ARG NH2 N 5.910 -6.522 1.491 1.00 . A A . 2 ARG NH2 1 1 7 794 1 1 2 ARG O O -1.327 -3.953 0.432 1.00 . A A . 2 ARG O 1 1 7 795 1 1 3 PHE C C -1.055 -0.603 0.019 1.00 . A A . 3 PHE C 1 1 7 796 1 1 3 PHE CA C -1.742 -1.317 1.176 1.00 . A A . 3 PHE CA 1 1 7 797 1 1 3 PHE CB C -2.269 -0.299 2.186 1.00 . A A . 3 PHE CB 1 1 7 798 1 1 3 PHE CD1 C -4.602 -1.206 1.893 1.00 . A A . 3 PHE CD1 1 1 7 799 1 1 3 PHE CD2 C -4.337 1.105 2.424 1.00 . A A . 3 PHE CD2 1 1 7 800 1 1 3 PHE CE1 C -5.975 -1.047 1.877 1.00 . A A . 3 PHE CE1 1 1 7 801 1 1 3 PHE CE2 C -5.709 1.268 2.409 1.00 . A A . 3 PHE CE2 1 1 7 802 1 1 3 PHE CG C -3.766 -0.132 2.166 1.00 . A A . 3 PHE CG 1 1 7 803 1 1 3 PHE CZ C -6.529 0.191 2.136 1.00 . A A . 3 PHE CZ 1 1 7 804 1 1 3 PHE H H -0.314 -1.959 2.599 1.00 . A A . 3 PHE H 1 1 7 805 1 1 3 PHE HA H -2.570 -1.876 0.785 1.00 . A A . 3 PHE HA 1 1 7 806 1 1 3 PHE HB2 H -1.984 -0.610 3.184 1.00 . A A . 3 PHE HB2 1 1 7 807 1 1 3 PHE HB3 H -1.827 0.661 1.968 1.00 . A A . 3 PHE HB3 1 1 7 808 1 1 3 PHE HD1 H -4.171 -2.175 1.689 1.00 . A A . 3 PHE HD1 1 1 7 809 1 1 3 PHE HD2 H -3.697 1.948 2.638 1.00 . A A . 3 PHE HD2 1 1 7 810 1 1 3 PHE HE1 H -6.614 -1.891 1.663 1.00 . A A . 3 PHE HE1 1 1 7 811 1 1 3 PHE HE2 H -6.140 2.238 2.611 1.00 . A A . 3 PHE HE2 1 1 7 812 1 1 3 PHE HZ H -7.601 0.317 2.124 1.00 . A A . 3 PHE HZ 1 1 7 813 1 1 3 PHE N N -0.837 -2.256 1.826 1.00 . A A . 3 PHE N 1 1 7 814 1 1 3 PHE O O 0.158 -0.711 -0.160 1.00 . A A . 3 PHE O 1 1 7 815 1 1 4 LEU C C -1.013 2.298 -1.554 1.00 . A A . 4 LEU C 1 1 7 816 1 1 4 LEU CA C -1.318 0.848 -1.914 1.00 . A A . 4 LEU CA 1 1 7 817 1 1 4 LEU CB C -2.309 0.792 -3.075 1.00 . A A . 4 LEU CB 1 1 7 818 1 1 4 LEU CD1 C -4.246 -0.594 -2.330 1.00 . A A . 4 LEU CD1 1 1 7 819 1 1 4 LEU CD2 C -3.420 -0.778 -4.684 1.00 . A A . 4 LEU CD2 1 1 7 820 1 1 4 LEU CG C -3.029 -0.545 -3.232 1.00 . A A . 4 LEU CG 1 1 7 821 1 1 4 LEU H H -2.801 0.163 -0.573 1.00 . A A . 4 LEU H 1 1 7 822 1 1 4 LEU HA H -0.408 0.363 -2.215 1.00 . A A . 4 LEU HA 1 1 7 823 1 1 4 LEU HB2 H -3.050 1.565 -2.928 1.00 . A A . 4 LEU HB2 1 1 7 824 1 1 4 LEU HB3 H -1.774 0.998 -3.990 1.00 . A A . 4 LEU HB3 1 1 7 825 1 1 4 LEU HD11 H -3.999 -1.137 -1.431 1.00 . A A . 4 LEU HD11 1 1 7 826 1 1 4 LEU HD12 H -5.057 -1.089 -2.842 1.00 . A A . 4 LEU HD12 1 1 7 827 1 1 4 LEU HD13 H -4.541 0.412 -2.072 1.00 . A A . 4 LEU HD13 1 1 7 828 1 1 4 LEU HD21 H -3.519 0.173 -5.187 1.00 . A A . 4 LEU HD21 1 1 7 829 1 1 4 LEU HD22 H -4.361 -1.306 -4.723 1.00 . A A . 4 LEU HD22 1 1 7 830 1 1 4 LEU HD23 H -2.657 -1.366 -5.172 1.00 . A A . 4 LEU HD23 1 1 7 831 1 1 4 LEU HG H -2.364 -1.340 -2.928 1.00 . A A . 4 LEU HG 1 1 7 832 1 1 4 LEU N N -1.843 0.121 -0.767 1.00 . A A . 4 LEU N 1 1 7 833 1 1 4 LEU O O -1.683 2.893 -0.710 1.00 . A A . 4 LEU O 1 1 7 834 1 1 5 ARG C C 0.737 4.957 -3.253 1.00 . A A . 5 ARG C 1 1 7 835 1 1 5 ARG CA C 0.396 4.243 -1.949 1.00 . A A . 5 ARG CA 1 1 7 836 1 1 5 ARG CB C 1.595 4.288 -1.000 1.00 . A A . 5 ARG CB 1 1 7 837 1 1 5 ARG CD C 2.390 6.618 -0.492 1.00 . A A . 5 ARG CD 1 1 7 838 1 1 5 ARG CG C 1.547 5.446 -0.016 1.00 . A A . 5 ARG CG 1 1 7 839 1 1 5 ARG CZ C 1.830 8.461 1.045 1.00 . A A . 5 ARG CZ 1 1 7 840 1 1 5 ARG H H 0.498 2.336 -2.863 1.00 . A A . 5 ARG H 1 1 7 841 1 1 5 ARG HA H -0.438 4.746 -1.484 1.00 . A A . 5 ARG HA 1 1 7 842 1 1 5 ARG HB2 H 1.628 3.364 -0.435 1.00 . A A . 5 ARG HB2 1 1 7 843 1 1 5 ARG HB3 H 2.502 4.380 -1.588 1.00 . A A . 5 ARG HB3 1 1 7 844 1 1 5 ARG HD2 H 3.360 6.561 -0.022 1.00 . A A . 5 ARG HD2 1 1 7 845 1 1 5 ARG HD3 H 2.506 6.549 -1.564 1.00 . A A . 5 ARG HD3 1 1 7 846 1 1 5 ARG HE H 1.302 8.374 -0.878 1.00 . A A . 5 ARG HE 1 1 7 847 1 1 5 ARG HG2 H 0.523 5.772 0.090 1.00 . A A . 5 ARG HG2 1 1 7 848 1 1 5 ARG HG3 H 1.921 5.109 0.939 1.00 . A A . 5 ARG HG3 1 1 7 849 1 1 5 ARG HH11 H 2.908 6.968 1.883 1.00 . A A . 5 ARG HH11 1 1 7 850 1 1 5 ARG HH12 H 2.502 8.276 2.943 1.00 . A A . 5 ARG HH12 1 1 7 851 1 1 5 ARG HH21 H 0.767 10.095 0.514 1.00 . A A . 5 ARG HH21 1 1 7 852 1 1 5 ARG HH22 H 1.286 10.051 2.166 1.00 . A A . 5 ARG HH22 1 1 7 853 1 1 5 ARG N N 0.002 2.862 -2.201 1.00 . A A . 5 ARG N 1 1 7 854 1 1 5 ARG NE N 1.777 7.902 -0.162 1.00 . A A . 5 ARG NE 1 1 7 855 1 1 5 ARG NH1 N 2.466 7.851 2.038 1.00 . A A . 5 ARG NH1 1 1 7 856 1 1 5 ARG NH2 N 1.246 9.632 1.259 1.00 . A A . 5 ARG NH2 1 1 7 857 1 1 5 ARG O O 0.944 4.320 -4.286 1.00 . A A . 5 ARG O 1 1 7 858 1 1 6 HIS C C 1.954 8.298 -3.996 1.00 . A A . 6 HIS C 1 1 7 859 1 1 6 HIS CA C 1.110 7.085 -4.374 1.00 . A A . 6 HIS CA 1 1 7 860 1 1 6 HIS CB C -0.176 7.541 -5.068 1.00 . A A . 6 HIS CB 1 1 7 861 1 1 6 HIS CD2 C -1.518 8.167 -2.938 1.00 . A A . 6 HIS CD2 1 1 7 862 1 1 6 HIS CE1 C -2.320 10.090 -3.619 1.00 . A A . 6 HIS CE1 1 1 7 863 1 1 6 HIS CG C -1.061 8.376 -4.195 1.00 . A A . 6 HIS CG 1 1 7 864 1 1 6 HIS H H 0.619 6.735 -2.345 1.00 . A A . 6 HIS H 1 1 7 865 1 1 6 HIS HA H 1.675 6.466 -5.055 1.00 . A A . 6 HIS HA 1 1 7 866 1 1 6 HIS HB2 H 0.082 8.130 -5.939 1.00 . A A . 6 HIS HB2 1 1 7 867 1 1 6 HIS HB3 H -0.739 6.667 -5.376 1.00 . A A . 6 HIS HB3 1 1 7 868 1 1 6 HIS HD1 H -1.433 10.019 -5.461 1.00 . A A . 6 HIS HD1 1 1 7 869 1 1 6 HIS HD2 H -1.308 7.310 -2.313 1.00 . A A . 6 HIS HD2 1 1 7 870 1 1 6 HIS HE1 H -2.853 11.029 -3.648 1.00 . A A . 6 HIS HE1 1 1 7 871 1 1 6 HIS HE2 H -2.830 9.333 -1.785 1.00 . A A . 6 HIS HE2 1 1 7 872 1 1 6 HIS N N 0.794 6.284 -3.198 1.00 . A A . 6 HIS N 1 1 7 873 1 1 6 HIS ND1 N -1.582 9.589 -4.593 1.00 . A A . 6 HIS ND1 1 1 7 874 1 1 6 HIS NE2 N -2.298 9.246 -2.604 1.00 . A A . 6 HIS NE2 1 1 7 875 1 1 6 HIS O O 2.755 8.747 -4.843 1.00 . A A . 6 HIS O 1 1 8 876 1 1 1 HIS C C 0.142 -6.367 2.595 1.00 . A A . 1 HIS C 1 1 8 877 1 1 1 HIS CA C 0.217 -7.813 2.113 1.00 . A A . 1 HIS CA 1 1 8 878 1 1 1 HIS CB C -1.043 -8.176 1.323 1.00 . A A . 1 HIS CB 1 1 8 879 1 1 1 HIS CD2 C -1.341 -9.427 -0.930 1.00 . A A . 1 HIS CD2 1 1 8 880 1 1 1 HIS CE1 C 0.192 -8.370 -2.088 1.00 . A A . 1 HIS CE1 1 1 8 881 1 1 1 HIS CG C -0.773 -8.509 -0.112 1.00 . A A . 1 HIS CG 1 1 8 882 1 1 1 HIS H1 H 1.018 -8.341 3.933 1.00 . A A . 1 HIS H1 1 1 8 883 1 1 1 HIS H2 H 0.693 -9.660 2.884 1.00 . A A . 1 HIS H2 1 1 8 884 1 1 1 HIS H3 H -0.597 -8.860 3.686 1.00 . A A . 1 HIS H3 1 1 8 885 1 1 1 HIS HA H 1.081 -7.928 1.476 1.00 . A A . 1 HIS HA 1 1 8 886 1 1 1 HIS HB2 H -1.511 -9.035 1.780 1.00 . A A . 1 HIS HB2 1 1 8 887 1 1 1 HIS HB3 H -1.730 -7.342 1.348 1.00 . A A . 1 HIS HB3 1 1 8 888 1 1 1 HIS HD1 H 0.769 -7.143 -0.556 1.00 . A A . 1 HIS HD1 1 1 8 889 1 1 1 HIS HD2 H -2.132 -10.115 -0.670 1.00 . A A . 1 HIS HD2 1 1 8 890 1 1 1 HIS HE1 H 0.839 -8.060 -2.896 1.00 . A A . 1 HIS HE1 1 1 8 891 1 1 1 HIS HE2 H -0.864 -9.917 -2.916 1.00 . A A . 1 HIS HE2 1 1 8 892 1 1 1 HIS N N 0.344 -8.753 3.257 1.00 . A A . 1 HIS N 1 1 8 893 1 1 1 HIS ND1 N 0.184 -7.864 -0.867 1.00 . A A . 1 HIS ND1 1 1 8 894 1 1 1 HIS NE2 N -0.722 -9.320 -2.152 1.00 . A A . 1 HIS NE2 1 1 8 895 1 1 1 HIS O O -0.262 -6.099 3.726 1.00 . A A . 1 HIS O 1 1 8 896 1 1 2 ARG C C -0.656 -3.318 1.387 1.00 . A A . 2 ARG C 1 1 8 897 1 1 2 ARG CA C 0.514 -4.021 2.065 1.00 . A A . 2 ARG CA 1 1 8 898 1 1 2 ARG CB C 1.833 -3.358 1.658 1.00 . A A . 2 ARG CB 1 1 8 899 1 1 2 ARG CD C 3.920 -2.644 2.864 1.00 . A A . 2 ARG CD 1 1 8 900 1 1 2 ARG CG C 2.417 -2.456 2.733 1.00 . A A . 2 ARG CG 1 1 8 901 1 1 2 ARG CZ C 4.210 -4.033 4.878 1.00 . A A . 2 ARG CZ 1 1 8 902 1 1 2 ARG H H 0.848 -5.715 0.841 1.00 . A A . 2 ARG H 1 1 8 903 1 1 2 ARG HA H 0.395 -3.936 3.135 1.00 . A A . 2 ARG HA 1 1 8 904 1 1 2 ARG HB2 H 2.555 -4.130 1.434 1.00 . A A . 2 ARG HB2 1 1 8 905 1 1 2 ARG HB3 H 1.667 -2.764 0.771 1.00 . A A . 2 ARG HB3 1 1 8 906 1 1 2 ARG HD2 H 4.355 -2.664 1.876 1.00 . A A . 2 ARG HD2 1 1 8 907 1 1 2 ARG HD3 H 4.327 -1.811 3.418 1.00 . A A . 2 ARG HD3 1 1 8 908 1 1 2 ARG HE H 4.536 -4.648 3.008 1.00 . A A . 2 ARG HE 1 1 8 909 1 1 2 ARG HG2 H 2.215 -1.427 2.475 1.00 . A A . 2 ARG HG2 1 1 8 910 1 1 2 ARG HG3 H 1.950 -2.690 3.679 1.00 . A A . 2 ARG HG3 1 1 8 911 1 1 2 ARG HH11 H 3.595 -2.142 5.247 1.00 . A A . 2 ARG HH11 1 1 8 912 1 1 2 ARG HH12 H 3.805 -3.140 6.646 1.00 . A A . 2 ARG HH12 1 1 8 913 1 1 2 ARG HH21 H 4.812 -5.962 4.847 1.00 . A A . 2 ARG HH21 1 1 8 914 1 1 2 ARG HH22 H 4.496 -5.309 6.420 1.00 . A A . 2 ARG HH22 1 1 8 915 1 1 2 ARG N N 0.536 -5.439 1.728 1.00 . A A . 2 ARG N 1 1 8 916 1 1 2 ARG NE N 4.258 -3.885 3.556 1.00 . A A . 2 ARG NE 1 1 8 917 1 1 2 ARG NH1 N 3.839 -3.022 5.654 1.00 . A A . 2 ARG NH1 1 1 8 918 1 1 2 ARG NH2 N 4.532 -5.197 5.427 1.00 . A A . 2 ARG NH2 1 1 8 919 1 1 2 ARG O O -1.403 -3.930 0.624 1.00 . A A . 2 ARG O 1 1 8 920 1 1 3 PHE C C -1.408 -0.438 -0.106 1.00 . A A . 3 PHE C 1 1 8 921 1 1 3 PHE CA C -1.893 -1.245 1.092 1.00 . A A . 3 PHE CA 1 1 8 922 1 1 3 PHE CB C -2.503 -0.317 2.141 1.00 . A A . 3 PHE CB 1 1 8 923 1 1 3 PHE CD1 C -4.700 -1.534 1.922 1.00 . A A . 3 PHE CD1 1 1 8 924 1 1 3 PHE CD2 C -4.731 0.768 2.547 1.00 . A A . 3 PHE CD2 1 1 8 925 1 1 3 PHE CE1 C -6.081 -1.572 1.983 1.00 . A A . 3 PHE CE1 1 1 8 926 1 1 3 PHE CE2 C -6.111 0.736 2.608 1.00 . A A . 3 PHE CE2 1 1 8 927 1 1 3 PHE CG C -4.008 -0.364 2.203 1.00 . A A . 3 PHE CG 1 1 8 928 1 1 3 PHE CZ C -6.786 -0.435 2.326 1.00 . A A . 3 PHE CZ 1 1 8 929 1 1 3 PHE H H -0.185 -1.597 2.290 1.00 . A A . 3 PHE H 1 1 8 930 1 1 3 PHE HA H -2.647 -1.927 0.755 1.00 . A A . 3 PHE HA 1 1 8 931 1 1 3 PHE HB2 H -2.123 -0.588 3.118 1.00 . A A . 3 PHE HB2 1 1 8 932 1 1 3 PHE HB3 H -2.214 0.697 1.911 1.00 . A A . 3 PHE HB3 1 1 8 933 1 1 3 PHE HD1 H -4.151 -2.424 1.652 1.00 . A A . 3 PHE HD1 1 1 8 934 1 1 3 PHE HD2 H -4.204 1.685 2.767 1.00 . A A . 3 PHE HD2 1 1 8 935 1 1 3 PHE HE1 H -6.607 -2.488 1.762 1.00 . A A . 3 PHE HE1 1 1 8 936 1 1 3 PHE HE2 H -6.661 1.625 2.877 1.00 . A A . 3 PHE HE2 1 1 8 937 1 1 3 PHE HZ H -7.865 -0.463 2.374 1.00 . A A . 3 PHE HZ 1 1 8 938 1 1 3 PHE N N -0.811 -2.029 1.673 1.00 . A A . 3 PHE N 1 1 8 939 1 1 3 PHE O O -0.209 -0.359 -0.374 1.00 . A A . 3 PHE O 1 1 8 940 1 1 4 LEU C C -1.589 2.352 -1.616 1.00 . A A . 4 LEU C 1 1 8 941 1 1 4 LEU CA C -2.035 0.946 -2.005 1.00 . A A . 4 LEU CA 1 1 8 942 1 1 4 LEU CB C -3.242 1.016 -2.938 1.00 . A A . 4 LEU CB 1 1 8 943 1 1 4 LEU CD1 C -4.994 -0.582 -2.150 1.00 . A A . 4 LEU CD1 1 1 8 944 1 1 4 LEU CD2 C -4.518 -0.366 -4.596 1.00 . A A . 4 LEU CD2 1 1 8 945 1 1 4 LEU CG C -3.925 -0.327 -3.195 1.00 . A A . 4 LEU CG 1 1 8 946 1 1 4 LEU H H -3.289 0.046 -0.562 1.00 . A A . 4 LEU H 1 1 8 947 1 1 4 LEU HA H -1.229 0.453 -2.520 1.00 . A A . 4 LEU HA 1 1 8 948 1 1 4 LEU HB2 H -3.967 1.691 -2.506 1.00 . A A . 4 LEU HB2 1 1 8 949 1 1 4 LEU HB3 H -2.918 1.417 -3.886 1.00 . A A . 4 LEU HB3 1 1 8 950 1 1 4 LEU HD11 H -5.832 -1.087 -2.606 1.00 . A A . 4 LEU HD11 1 1 8 951 1 1 4 LEU HD12 H -5.320 0.359 -1.734 1.00 . A A . 4 LEU HD12 1 1 8 952 1 1 4 LEU HD13 H -4.582 -1.199 -1.366 1.00 . A A . 4 LEU HD13 1 1 8 953 1 1 4 LEU HD21 H -3.795 -0.781 -5.282 1.00 . A A . 4 LEU HD21 1 1 8 954 1 1 4 LEU HD22 H -4.775 0.636 -4.906 1.00 . A A . 4 LEU HD22 1 1 8 955 1 1 4 LEU HD23 H -5.406 -0.981 -4.593 1.00 . A A . 4 LEU HD23 1 1 8 956 1 1 4 LEU HG H -3.192 -1.116 -3.116 1.00 . A A . 4 LEU HG 1 1 8 957 1 1 4 LEU N N -2.353 0.152 -0.827 1.00 . A A . 4 LEU N 1 1 8 958 1 1 4 LEU O O -2.325 3.087 -0.957 1.00 . A A . 4 LEU O 1 1 8 959 1 1 5 ARG C C 0.899 4.615 -2.928 1.00 . A A . 5 ARG C 1 1 8 960 1 1 5 ARG CA C 0.163 4.038 -1.724 1.00 . A A . 5 ARG CA 1 1 8 961 1 1 5 ARG CB C 1.109 3.956 -0.524 1.00 . A A . 5 ARG CB 1 1 8 962 1 1 5 ARG CD C 2.169 6.132 0.156 1.00 . A A . 5 ARG CD 1 1 8 963 1 1 5 ARG CG C 1.024 5.162 0.399 1.00 . A A . 5 ARG CG 1 1 8 964 1 1 5 ARG CZ C 1.576 8.141 1.454 1.00 . A A . 5 ARG CZ 1 1 8 965 1 1 5 ARG H H 0.159 2.089 -2.550 1.00 . A A . 5 ARG H 1 1 8 966 1 1 5 ARG HA H -0.663 4.687 -1.476 1.00 . A A . 5 ARG HA 1 1 8 967 1 1 5 ARG HB2 H 0.865 3.071 0.053 1.00 . A A . 5 ARG HB2 1 1 8 968 1 1 5 ARG HB3 H 2.127 3.877 -0.887 1.00 . A A . 5 ARG HB3 1 1 8 969 1 1 5 ARG HD2 H 2.949 5.935 0.876 1.00 . A A . 5 ARG HD2 1 1 8 970 1 1 5 ARG HD3 H 2.552 5.974 -0.841 1.00 . A A . 5 ARG HD3 1 1 8 971 1 1 5 ARG HE H 1.576 8.025 -0.539 1.00 . A A . 5 ARG HE 1 1 8 972 1 1 5 ARG HG2 H 0.089 5.673 0.222 1.00 . A A . 5 ARG HG2 1 1 8 973 1 1 5 ARG HG3 H 1.062 4.822 1.423 1.00 . A A . 5 ARG HG3 1 1 8 974 1 1 5 ARG HH11 H 2.087 6.538 2.577 1.00 . A A . 5 ARG HH11 1 1 8 975 1 1 5 ARG HH12 H 1.666 7.964 3.466 1.00 . A A . 5 ARG HH12 1 1 8 976 1 1 5 ARG HH21 H 1.022 9.901 0.628 1.00 . A A . 5 ARG HH21 1 1 8 977 1 1 5 ARG HH22 H 1.061 9.873 2.360 1.00 . A A . 5 ARG HH22 1 1 8 978 1 1 5 ARG N N -0.381 2.719 -2.029 1.00 . A A . 5 ARG N 1 1 8 979 1 1 5 ARG NE N 1.744 7.524 0.287 1.00 . A A . 5 ARG NE 1 1 8 980 1 1 5 ARG NH1 N 1.794 7.494 2.592 1.00 . A A . 5 ARG NH1 1 1 8 981 1 1 5 ARG NH2 N 1.188 9.409 1.483 1.00 . A A . 5 ARG NH2 1 1 8 982 1 1 5 ARG O O 1.506 3.880 -3.708 1.00 . A A . 5 ARG O 1 1 8 983 1 1 6 HIS C C 2.699 7.418 -3.695 1.00 . A A . 6 HIS C 1 1 8 984 1 1 6 HIS CA C 1.502 6.611 -4.185 1.00 . A A . 6 HIS CA 1 1 8 985 1 1 6 HIS CB C 0.516 7.528 -4.911 1.00 . A A . 6 HIS CB 1 1 8 986 1 1 6 HIS CD2 C 0.261 9.102 -2.864 1.00 . A A . 6 HIS CD2 1 1 8 987 1 1 6 HIS CE1 C -1.762 9.838 -3.276 1.00 . A A . 6 HIS CE1 1 1 8 988 1 1 6 HIS CG C -0.162 8.510 -4.007 1.00 . A A . 6 HIS CG 1 1 8 989 1 1 6 HIS H H 0.341 6.466 -2.421 1.00 . A A . 6 HIS H 1 1 8 990 1 1 6 HIS HA H 1.849 5.855 -4.873 1.00 . A A . 6 HIS HA 1 1 8 991 1 1 6 HIS HB2 H 1.047 8.088 -5.670 1.00 . A A . 6 HIS HB2 1 1 8 992 1 1 6 HIS HB3 H -0.251 6.922 -5.380 1.00 . A A . 6 HIS HB3 1 1 8 993 1 1 6 HIS HD1 H -2.009 8.751 -4.992 1.00 . A A . 6 HIS HD1 1 1 8 994 1 1 6 HIS HD2 H 1.218 8.956 -2.383 1.00 . A A . 6 HIS HD2 1 1 8 995 1 1 6 HIS HE1 H -2.699 10.370 -3.196 1.00 . A A . 6 HIS HE1 1 1 8 996 1 1 6 HIS HE2 H -0.765 10.411 -1.582 1.00 . A A . 6 HIS HE2 1 1 8 997 1 1 6 HIS N N 0.840 5.934 -3.075 1.00 . A A . 6 HIS N 1 1 8 998 1 1 6 HIS ND1 N -1.434 8.992 -4.237 1.00 . A A . 6 HIS ND1 1 1 8 999 1 1 6 HIS NE2 N -0.752 9.922 -2.431 1.00 . A A . 6 HIS NE2 1 1 8 1000 1 1 6 HIS O O 3.419 7.983 -4.546 1.00 . A A . 6 HIS O 1 1 9 1001 1 1 1 HIS C C -0.242 -6.570 2.947 1.00 . A A . 1 HIS C 1 1 9 1002 1 1 1 HIS CA C -0.687 -8.024 2.819 1.00 . A A . 1 HIS CA 1 1 9 1003 1 1 1 HIS CB C -2.094 -8.099 2.221 1.00 . A A . 1 HIS CB 1 1 9 1004 1 1 1 HIS CD2 C -2.653 -10.078 0.640 1.00 . A A . 1 HIS CD2 1 1 9 1005 1 1 1 HIS CE1 C -1.857 -9.236 -1.221 1.00 . A A . 1 HIS CE1 1 1 9 1006 1 1 1 HIS CG C -2.155 -8.852 0.929 1.00 . A A . 1 HIS CG 1 1 9 1007 1 1 1 HIS H1 H -1.240 -9.581 4.044 1.00 . A A . 1 HIS H1 1 1 9 1008 1 1 1 HIS H2 H -1.153 -8.054 4.823 1.00 . A A . 1 HIS H2 1 1 9 1009 1 1 1 HIS H3 H 0.287 -8.893 4.410 1.00 . A A . 1 HIS H3 1 1 9 1010 1 1 1 HIS HA H 0.003 -8.547 2.173 1.00 . A A . 1 HIS HA 1 1 9 1011 1 1 1 HIS HB2 H -2.749 -8.593 2.923 1.00 . A A . 1 HIS HB2 1 1 9 1012 1 1 1 HIS HB3 H -2.457 -7.098 2.041 1.00 . A A . 1 HIS HB3 1 1 9 1013 1 1 1 HIS HD1 H -1.236 -7.478 -0.378 1.00 . A A . 1 HIS HD1 1 1 9 1014 1 1 1 HIS HD2 H -3.120 -10.761 1.336 1.00 . A A . 1 HIS HD2 1 1 9 1015 1 1 1 HIS HE1 H -1.573 -9.116 -2.256 1.00 . A A . 1 HIS HE1 1 1 9 1016 1 1 1 HIS HE2 H -2.785 -11.062 -1.211 1.00 . A A . 1 HIS HE2 1 1 9 1017 1 1 1 HIS N N -0.699 -8.699 4.143 1.00 . A A . 1 HIS N 1 1 9 1018 1 1 1 HIS ND1 N -1.663 -8.352 -0.258 1.00 . A A . 1 HIS ND1 1 1 9 1019 1 1 1 HIS NE2 N -2.455 -10.292 -0.702 1.00 . A A . 1 HIS NE2 1 1 9 1020 1 1 1 HIS O O -0.214 -6.013 4.044 1.00 . A A . 1 HIS O 1 1 9 1021 1 1 2 ARG C C -0.557 -3.651 1.299 1.00 . A A . 2 ARG C 1 1 9 1022 1 1 2 ARG CA C 0.549 -4.571 1.805 1.00 . A A . 2 ARG CA 1 1 9 1023 1 1 2 ARG CB C 1.795 -4.419 0.930 1.00 . A A . 2 ARG CB 1 1 9 1024 1 1 2 ARG CD C 2.239 -6.385 -0.572 1.00 . A A . 2 ARG CD 1 1 9 1025 1 1 2 ARG CG C 1.632 -4.995 -0.467 1.00 . A A . 2 ARG CG 1 1 9 1026 1 1 2 ARG CZ C 2.164 -8.295 -2.126 1.00 . A A . 2 ARG CZ 1 1 9 1027 1 1 2 ARG H H 0.063 -6.457 0.974 1.00 . A A . 2 ARG H 1 1 9 1028 1 1 2 ARG HA H 0.795 -4.293 2.818 1.00 . A A . 2 ARG HA 1 1 9 1029 1 1 2 ARG HB2 H 2.030 -3.369 0.839 1.00 . A A . 2 ARG HB2 1 1 9 1030 1 1 2 ARG HB3 H 2.621 -4.923 1.410 1.00 . A A . 2 ARG HB3 1 1 9 1031 1 1 2 ARG HD2 H 3.308 -6.308 -0.440 1.00 . A A . 2 ARG HD2 1 1 9 1032 1 1 2 ARG HD3 H 1.825 -7.004 0.210 1.00 . A A . 2 ARG HD3 1 1 9 1033 1 1 2 ARG HE H 1.614 -6.431 -2.578 1.00 . A A . 2 ARG HE 1 1 9 1034 1 1 2 ARG HG2 H 0.580 -5.054 -0.701 1.00 . A A . 2 ARG HG2 1 1 9 1035 1 1 2 ARG HG3 H 2.124 -4.342 -1.174 1.00 . A A . 2 ARG HG3 1 1 9 1036 1 1 2 ARG HH11 H 2.848 -8.746 -0.276 1.00 . A A . 2 ARG HH11 1 1 9 1037 1 1 2 ARG HH12 H 2.786 -10.072 -1.388 1.00 . A A . 2 ARG HH12 1 1 9 1038 1 1 2 ARG HH21 H 1.531 -8.174 -4.041 1.00 . A A . 2 ARG HH21 1 1 9 1039 1 1 2 ARG HH22 H 2.039 -9.748 -3.526 1.00 . A A . 2 ARG HH22 1 1 9 1040 1 1 2 ARG N N 0.105 -5.961 1.818 1.00 . A A . 2 ARG N 1 1 9 1041 1 1 2 ARG NE N 1.965 -7.005 -1.865 1.00 . A A . 2 ARG NE 1 1 9 1042 1 1 2 ARG NH1 N 2.639 -9.104 -1.186 1.00 . A A . 2 ARG NH1 1 1 9 1043 1 1 2 ARG NH2 N 1.889 -8.779 -3.329 1.00 . A A . 2 ARG NH2 1 1 9 1044 1 1 2 ARG O O -1.625 -4.111 0.895 1.00 . A A . 2 ARG O 1 1 9 1045 1 1 3 PHE C C -0.756 -0.600 -0.339 1.00 . A A . 3 PHE C 1 1 9 1046 1 1 3 PHE CA C -1.268 -1.364 0.875 1.00 . A A . 3 PHE CA 1 1 9 1047 1 1 3 PHE CB C -1.609 -0.393 2.004 1.00 . A A . 3 PHE CB 1 1 9 1048 1 1 3 PHE CD1 C -3.980 -1.251 2.004 1.00 . A A . 3 PHE CD1 1 1 9 1049 1 1 3 PHE CD2 C -3.582 0.998 2.693 1.00 . A A . 3 PHE CD2 1 1 9 1050 1 1 3 PHE CE1 C -5.334 -1.081 2.222 1.00 . A A . 3 PHE CE1 1 1 9 1051 1 1 3 PHE CE2 C -4.936 1.173 2.911 1.00 . A A . 3 PHE CE2 1 1 9 1052 1 1 3 PHE CG C -3.088 -0.213 2.237 1.00 . A A . 3 PHE CG 1 1 9 1053 1 1 3 PHE CZ C -5.813 0.133 2.675 1.00 . A A . 3 PHE CZ 1 1 9 1054 1 1 3 PHE H H 0.575 -2.043 1.662 1.00 . A A . 3 PHE H 1 1 9 1055 1 1 3 PHE HA H -2.158 -1.889 0.591 1.00 . A A . 3 PHE HA 1 1 9 1056 1 1 3 PHE HB2 H -1.171 -0.754 2.927 1.00 . A A . 3 PHE HB2 1 1 9 1057 1 1 3 PHE HB3 H -1.194 0.574 1.763 1.00 . A A . 3 PHE HB3 1 1 9 1058 1 1 3 PHE HD1 H -3.609 -2.200 1.648 1.00 . A A . 3 PHE HD1 1 1 9 1059 1 1 3 PHE HD2 H -2.898 1.813 2.877 1.00 . A A . 3 PHE HD2 1 1 9 1060 1 1 3 PHE HE1 H -6.018 -1.896 2.036 1.00 . A A . 3 PHE HE1 1 1 9 1061 1 1 3 PHE HE2 H -5.307 2.123 3.266 1.00 . A A . 3 PHE HE2 1 1 9 1062 1 1 3 PHE HZ H -6.870 0.268 2.846 1.00 . A A . 3 PHE HZ 1 1 9 1063 1 1 3 PHE N N -0.294 -2.349 1.328 1.00 . A A . 3 PHE N 1 1 9 1064 1 1 3 PHE O O 0.410 -0.717 -0.717 1.00 . A A . 3 PHE O 1 1 9 1065 1 1 4 LEU C C -0.672 2.294 -1.741 1.00 . A A . 4 LEU C 1 1 9 1066 1 1 4 LEU CA C -1.294 0.956 -2.129 1.00 . A A . 4 LEU CA 1 1 9 1067 1 1 4 LEU CB C -2.531 1.184 -2.996 1.00 . A A . 4 LEU CB 1 1 9 1068 1 1 4 LEU CD1 C -4.421 -0.161 -2.070 1.00 . A A . 4 LEU CD1 1 1 9 1069 1 1 4 LEU CD2 C -4.098 -0.012 -4.545 1.00 . A A . 4 LEU CD2 1 1 9 1070 1 1 4 LEU CG C -3.406 -0.053 -3.191 1.00 . A A . 4 LEU CG 1 1 9 1071 1 1 4 LEU H H -2.556 0.222 -0.602 1.00 . A A . 4 LEU H 1 1 9 1072 1 1 4 LEU HA H -0.577 0.387 -2.693 1.00 . A A . 4 LEU HA 1 1 9 1073 1 1 4 LEU HB2 H -3.130 1.958 -2.538 1.00 . A A . 4 LEU HB2 1 1 9 1074 1 1 4 LEU HB3 H -2.208 1.526 -3.967 1.00 . A A . 4 LEU HB3 1 1 9 1075 1 1 4 LEU HD11 H -4.576 0.814 -1.632 1.00 . A A . 4 LEU HD11 1 1 9 1076 1 1 4 LEU HD12 H -4.048 -0.838 -1.317 1.00 . A A . 4 LEU HD12 1 1 9 1077 1 1 4 LEU HD13 H -5.355 -0.534 -2.462 1.00 . A A . 4 LEU HD13 1 1 9 1078 1 1 4 LEU HD21 H -3.509 -0.559 -5.267 1.00 . A A . 4 LEU HD21 1 1 9 1079 1 1 4 LEU HD22 H -4.199 1.014 -4.867 1.00 . A A . 4 LEU HD22 1 1 9 1080 1 1 4 LEU HD23 H -5.076 -0.462 -4.463 1.00 . A A . 4 LEU HD23 1 1 9 1081 1 1 4 LEU HG H -2.783 -0.935 -3.155 1.00 . A A . 4 LEU HG 1 1 9 1082 1 1 4 LEU N N -1.643 0.177 -0.950 1.00 . A A . 4 LEU N 1 1 9 1083 1 1 4 LEU O O -1.120 2.949 -0.800 1.00 . A A . 4 LEU O 1 1 9 1084 1 1 5 ARG C C 0.716 4.989 -3.276 1.00 . A A . 5 ARG C 1 1 9 1085 1 1 5 ARG CA C 1.047 3.953 -2.206 1.00 . A A . 5 ARG CA 1 1 9 1086 1 1 5 ARG CB C 2.560 3.733 -2.142 1.00 . A A . 5 ARG CB 1 1 9 1087 1 1 5 ARG CD C 3.864 5.823 -1.640 1.00 . A A . 5 ARG CD 1 1 9 1088 1 1 5 ARG CG C 3.248 4.557 -1.066 1.00 . A A . 5 ARG CG 1 1 9 1089 1 1 5 ARG CZ C 4.175 7.243 0.351 1.00 . A A . 5 ARG CZ 1 1 9 1090 1 1 5 ARG H H 0.674 2.128 -3.210 1.00 . A A . 5 ARG H 1 1 9 1091 1 1 5 ARG HA H 0.705 4.320 -1.250 1.00 . A A . 5 ARG HA 1 1 9 1092 1 1 5 ARG HB2 H 2.751 2.685 -1.940 1.00 . A A . 5 ARG HB2 1 1 9 1093 1 1 5 ARG HB3 H 2.992 3.997 -3.100 1.00 . A A . 5 ARG HB3 1 1 9 1094 1 1 5 ARG HD2 H 4.934 5.691 -1.702 1.00 . A A . 5 ARG HD2 1 1 9 1095 1 1 5 ARG HD3 H 3.465 5.987 -2.630 1.00 . A A . 5 ARG HD3 1 1 9 1096 1 1 5 ARG HE H 2.910 7.629 -1.143 1.00 . A A . 5 ARG HE 1 1 9 1097 1 1 5 ARG HG2 H 2.520 4.832 -0.316 1.00 . A A . 5 ARG HG2 1 1 9 1098 1 1 5 ARG HG3 H 4.026 3.961 -0.613 1.00 . A A . 5 ARG HG3 1 1 9 1099 1 1 5 ARG HH11 H 5.332 5.584 0.316 1.00 . A A . 5 ARG HH11 1 1 9 1100 1 1 5 ARG HH12 H 5.532 6.599 1.705 1.00 . A A . 5 ARG HH12 1 1 9 1101 1 1 5 ARG HH21 H 3.171 8.965 0.682 1.00 . A A . 5 ARG HH21 1 1 9 1102 1 1 5 ARG HH22 H 4.305 8.518 1.913 1.00 . A A . 5 ARG HH22 1 1 9 1103 1 1 5 ARG N N 0.363 2.693 -2.473 1.00 . A A . 5 ARG N 1 1 9 1104 1 1 5 ARG NE N 3.580 6.994 -0.813 1.00 . A A . 5 ARG NE 1 1 9 1105 1 1 5 ARG NH1 N 5.088 6.406 0.829 1.00 . A A . 5 ARG NH1 1 1 9 1106 1 1 5 ARG NH2 N 3.858 8.331 1.038 1.00 . A A . 5 ARG NH2 1 1 9 1107 1 1 5 ARG O O 0.581 4.657 -4.454 1.00 . A A . 5 ARG O 1 1 9 1108 1 1 6 HIS C C 1.201 8.517 -3.560 1.00 . A A . 6 HIS C 1 1 9 1109 1 1 6 HIS CA C 0.272 7.328 -3.781 1.00 . A A . 6 HIS CA 1 1 9 1110 1 1 6 HIS CB C -1.184 7.764 -3.609 1.00 . A A . 6 HIS CB 1 1 9 1111 1 1 6 HIS CD2 C -0.693 8.479 -1.164 1.00 . A A . 6 HIS CD2 1 1 9 1112 1 1 6 HIS CE1 C -2.702 9.167 -0.622 1.00 . A A . 6 HIS CE1 1 1 9 1113 1 1 6 HIS CG C -1.487 8.307 -2.247 1.00 . A A . 6 HIS CG 1 1 9 1114 1 1 6 HIS H H 0.707 6.445 -1.906 1.00 . A A . 6 HIS H 1 1 9 1115 1 1 6 HIS HA H 0.412 6.959 -4.786 1.00 . A A . 6 HIS HA 1 1 9 1116 1 1 6 HIS HB2 H -1.408 8.539 -4.332 1.00 . A A . 6 HIS HB2 1 1 9 1117 1 1 6 HIS HB3 H -1.831 6.911 -3.781 1.00 . A A . 6 HIS HB3 1 1 9 1118 1 1 6 HIS HD1 H -3.538 8.752 -2.443 1.00 . A A . 6 HIS HD1 1 1 9 1119 1 1 6 HIS HD2 H 0.359 8.239 -1.096 1.00 . A A . 6 HIS HD2 1 1 9 1120 1 1 6 HIS HE1 H -3.536 9.567 -0.064 1.00 . A A . 6 HIS HE1 1 1 9 1121 1 1 6 HIS HE2 H -1.189 9.162 0.758 1.00 . A A . 6 HIS HE2 1 1 9 1122 1 1 6 HIS N N 0.587 6.243 -2.858 1.00 . A A . 6 HIS N 1 1 9 1123 1 1 6 HIS ND1 N -2.740 8.747 -1.874 1.00 . A A . 6 HIS ND1 1 1 9 1124 1 1 6 HIS NE2 N -1.472 9.014 -0.169 1.00 . A A . 6 HIS NE2 1 1 9 1125 1 1 6 HIS O O 1.113 9.489 -4.340 1.00 . A A . 6 HIS O 1 1 10 1126 1 1 1 HIS C C -0.091 -6.419 2.705 1.00 . A A . 1 HIS C 1 1 10 1127 1 1 1 HIS CA C -0.209 -7.897 2.344 1.00 . A A . 1 HIS CA 1 1 10 1128 1 1 1 HIS CB C -1.528 -8.158 1.615 1.00 . A A . 1 HIS CB 1 1 10 1129 1 1 1 HIS CD2 C -1.587 -10.751 1.670 1.00 . A A . 1 HIS CD2 1 1 10 1130 1 1 1 HIS CE1 C -1.890 -11.110 -0.472 1.00 . A A . 1 HIS CE1 1 1 10 1131 1 1 1 HIS CG C -1.640 -9.544 1.059 1.00 . A A . 1 HIS CG 1 1 10 1132 1 1 1 HIS H1 H 0.578 -8.375 4.184 1.00 . A A . 1 HIS H1 1 1 10 1133 1 1 1 HIS H2 H 0.058 -9.722 3.256 1.00 . A A . 1 HIS H2 1 1 10 1134 1 1 1 HIS H3 H -1.096 -8.704 4.016 1.00 . A A . 1 HIS H3 1 1 10 1135 1 1 1 HIS HA H 0.614 -8.169 1.701 1.00 . A A . 1 HIS HA 1 1 10 1136 1 1 1 HIS HB2 H -2.347 -8.010 2.302 1.00 . A A . 1 HIS HB2 1 1 10 1137 1 1 1 HIS HB3 H -1.622 -7.461 0.795 1.00 . A A . 1 HIS HB3 1 1 10 1138 1 1 1 HIS HD1 H -1.910 -9.131 -0.990 1.00 . A A . 1 HIS HD1 1 1 10 1139 1 1 1 HIS HD2 H -1.446 -10.929 2.727 1.00 . A A . 1 HIS HD2 1 1 10 1140 1 1 1 HIS HE1 H -2.032 -11.605 -1.421 1.00 . A A . 1 HIS HE1 1 1 10 1141 1 1 1 HIS HE2 H -1.835 -12.670 0.854 1.00 . A A . 1 HIS HE2 1 1 10 1142 1 1 1 HIS N N -0.163 -8.751 3.560 1.00 . A A . 1 HIS N 1 1 10 1143 1 1 1 HIS ND1 N -1.830 -9.804 -0.283 1.00 . A A . 1 HIS ND1 1 1 10 1144 1 1 1 HIS NE2 N -1.744 -11.707 0.697 1.00 . A A . 1 HIS NE2 1 1 10 1145 1 1 1 HIS O O -0.463 -6.006 3.803 1.00 . A A . 1 HIS O 1 1 10 1146 1 1 2 ARG C C -0.542 -3.411 1.347 1.00 . A A . 2 ARG C 1 1 10 1147 1 1 2 ARG CA C 0.595 -4.196 1.991 1.00 . A A . 2 ARG CA 1 1 10 1148 1 1 2 ARG CB C 1.938 -3.726 1.429 1.00 . A A . 2 ARG CB 1 1 10 1149 1 1 2 ARG CD C 3.303 -2.482 3.137 1.00 . A A . 2 ARG CD 1 1 10 1150 1 1 2 ARG CG C 3.080 -3.810 2.430 1.00 . A A . 2 ARG CG 1 1 10 1151 1 1 2 ARG CZ C 3.497 -1.644 5.446 1.00 . A A . 2 ARG CZ 1 1 10 1152 1 1 2 ARG H H 0.706 -6.016 0.916 1.00 . A A . 2 ARG H 1 1 10 1153 1 1 2 ARG HA H 0.580 -4.020 3.056 1.00 . A A . 2 ARG HA 1 1 10 1154 1 1 2 ARG HB2 H 2.191 -4.336 0.575 1.00 . A A . 2 ARG HB2 1 1 10 1155 1 1 2 ARG HB3 H 1.842 -2.698 1.110 1.00 . A A . 2 ARG HB3 1 1 10 1156 1 1 2 ARG HD2 H 4.297 -2.129 2.908 1.00 . A A . 2 ARG HD2 1 1 10 1157 1 1 2 ARG HD3 H 2.577 -1.768 2.776 1.00 . A A . 2 ARG HD3 1 1 10 1158 1 1 2 ARG HE H 2.810 -3.447 4.938 1.00 . A A . 2 ARG HE 1 1 10 1159 1 1 2 ARG HG2 H 2.845 -4.563 3.167 1.00 . A A . 2 ARG HG2 1 1 10 1160 1 1 2 ARG HG3 H 3.984 -4.085 1.907 1.00 . A A . 2 ARG HG3 1 1 10 1161 1 1 2 ARG HH11 H 4.102 -0.336 4.027 1.00 . A A . 2 ARG HH11 1 1 10 1162 1 1 2 ARG HH12 H 4.228 0.229 5.658 1.00 . A A . 2 ARG HH12 1 1 10 1163 1 1 2 ARG HH21 H 2.975 -2.706 7.085 1.00 . A A . 2 ARG HH21 1 1 10 1164 1 1 2 ARG HH22 H 3.589 -1.116 7.395 1.00 . A A . 2 ARG HH22 1 1 10 1165 1 1 2 ARG N N 0.429 -5.628 1.772 1.00 . A A . 2 ARG N 1 1 10 1166 1 1 2 ARG NE N 3.166 -2.605 4.587 1.00 . A A . 2 ARG NE 1 1 10 1167 1 1 2 ARG NH1 N 3.982 -0.489 5.007 1.00 . A A . 2 ARG NH1 1 1 10 1168 1 1 2 ARG NH2 N 3.341 -1.837 6.749 1.00 . A A . 2 ARG NH2 1 1 10 1169 1 1 2 ARG O O -1.398 -3.981 0.671 1.00 . A A . 2 ARG O 1 1 10 1170 1 1 3 PHE C C -1.075 -0.512 -0.240 1.00 . A A . 3 PHE C 1 1 10 1171 1 1 3 PHE CA C -1.578 -1.237 1.003 1.00 . A A . 3 PHE CA 1 1 10 1172 1 1 3 PHE CB C -2.052 -0.227 2.045 1.00 . A A . 3 PHE CB 1 1 10 1173 1 1 3 PHE CD1 C -4.359 -1.238 2.001 1.00 . A A . 3 PHE CD1 1 1 10 1174 1 1 3 PHE CD2 C -4.149 1.099 2.430 1.00 . A A . 3 PHE CD2 1 1 10 1175 1 1 3 PHE CE1 C -5.733 -1.137 2.109 1.00 . A A . 3 PHE CE1 1 1 10 1176 1 1 3 PHE CE2 C -5.522 1.205 2.539 1.00 . A A . 3 PHE CE2 1 1 10 1177 1 1 3 PHE CG C -3.550 -0.122 2.160 1.00 . A A . 3 PHE CG 1 1 10 1178 1 1 3 PHE CZ C -6.315 0.086 2.378 1.00 . A A . 3 PHE CZ 1 1 10 1179 1 1 3 PHE H H 0.165 -1.703 2.110 1.00 . A A . 3 PHE H 1 1 10 1180 1 1 3 PHE HA H -2.406 -1.856 0.721 1.00 . A A . 3 PHE HA 1 1 10 1181 1 1 3 PHE HB2 H -1.664 -0.511 3.016 1.00 . A A . 3 PHE HB2 1 1 10 1182 1 1 3 PHE HB3 H -1.673 0.747 1.777 1.00 . A A . 3 PHE HB3 1 1 10 1183 1 1 3 PHE HD1 H -3.906 -2.196 1.790 1.00 . A A . 3 PHE HD1 1 1 10 1184 1 1 3 PHE HD2 H -3.530 1.975 2.556 1.00 . A A . 3 PHE HD2 1 1 10 1185 1 1 3 PHE HE1 H -6.351 -2.014 1.983 1.00 . A A . 3 PHE HE1 1 1 10 1186 1 1 3 PHE HE2 H -5.975 2.163 2.749 1.00 . A A . 3 PHE HE2 1 1 10 1187 1 1 3 PHE HZ H -7.389 0.167 2.463 1.00 . A A . 3 PHE HZ 1 1 10 1188 1 1 3 PHE N N -0.545 -2.099 1.562 1.00 . A A . 3 PHE N 1 1 10 1189 1 1 3 PHE O O 0.114 -0.548 -0.556 1.00 . A A . 3 PHE O 1 1 10 1190 1 1 4 LEU C C -1.346 2.332 -1.853 1.00 . A A . 4 LEU C 1 1 10 1191 1 1 4 LEU CA C -1.651 0.869 -2.157 1.00 . A A . 4 LEU CA 1 1 10 1192 1 1 4 LEU CB C -2.786 0.770 -3.175 1.00 . A A . 4 LEU CB 1 1 10 1193 1 1 4 LEU CD1 C -4.554 -0.691 -2.187 1.00 . A A . 4 LEU CD1 1 1 10 1194 1 1 4 LEU CD2 C -4.031 -0.849 -4.630 1.00 . A A . 4 LEU CD2 1 1 10 1195 1 1 4 LEU CG C -3.466 -0.596 -3.239 1.00 . A A . 4 LEU CG 1 1 10 1196 1 1 4 LEU H H -2.923 0.128 -0.641 1.00 . A A . 4 LEU H 1 1 10 1197 1 1 4 LEU HA H -0.774 0.409 -2.574 1.00 . A A . 4 LEU HA 1 1 10 1198 1 1 4 LEU HB2 H -3.531 1.512 -2.926 1.00 . A A . 4 LEU HB2 1 1 10 1199 1 1 4 LEU HB3 H -2.388 0.996 -4.153 1.00 . A A . 4 LEU HB3 1 1 10 1200 1 1 4 LEU HD11 H -5.501 -0.901 -2.660 1.00 . A A . 4 LEU HD11 1 1 10 1201 1 1 4 LEU HD12 H -4.616 0.245 -1.652 1.00 . A A . 4 LEU HD12 1 1 10 1202 1 1 4 LEU HD13 H -4.312 -1.484 -1.495 1.00 . A A . 4 LEU HD13 1 1 10 1203 1 1 4 LEU HD21 H -3.261 -1.267 -5.261 1.00 . A A . 4 LEU HD21 1 1 10 1204 1 1 4 LEU HD22 H -4.376 0.083 -5.053 1.00 . A A . 4 LEU HD22 1 1 10 1205 1 1 4 LEU HD23 H -4.856 -1.542 -4.562 1.00 . A A . 4 LEU HD23 1 1 10 1206 1 1 4 LEU HG H -2.735 -1.363 -3.027 1.00 . A A . 4 LEU HG 1 1 10 1207 1 1 4 LEU N N -1.993 0.141 -0.943 1.00 . A A . 4 LEU N 1 1 10 1208 1 1 4 LEU O O -2.249 3.120 -1.576 1.00 . A A . 4 LEU O 1 1 10 1209 1 1 5 ARG C C 0.745 4.771 -2.929 1.00 . A A . 5 ARG C 1 1 10 1210 1 1 5 ARG CA C 0.358 4.057 -1.638 1.00 . A A . 5 ARG CA 1 1 10 1211 1 1 5 ARG CB C 1.536 4.066 -0.662 1.00 . A A . 5 ARG CB 1 1 10 1212 1 1 5 ARG CD C 2.322 6.375 -0.052 1.00 . A A . 5 ARG CD 1 1 10 1213 1 1 5 ARG CG C 1.468 5.187 0.361 1.00 . A A . 5 ARG CG 1 1 10 1214 1 1 5 ARG CZ C 1.268 8.117 1.335 1.00 . A A . 5 ARG CZ 1 1 10 1215 1 1 5 ARG H H 0.608 2.015 -2.134 1.00 . A A . 5 ARG H 1 1 10 1216 1 1 5 ARG HA H -0.474 4.579 -1.188 1.00 . A A . 5 ARG HA 1 1 10 1217 1 1 5 ARG HB2 H 1.555 3.122 -0.130 1.00 . A A . 5 ARG HB2 1 1 10 1218 1 1 5 ARG HB3 H 2.456 4.176 -1.226 1.00 . A A . 5 ARG HB3 1 1 10 1219 1 1 5 ARG HD2 H 3.226 6.376 0.540 1.00 . A A . 5 ARG HD2 1 1 10 1220 1 1 5 ARG HD3 H 2.578 6.273 -1.097 1.00 . A A . 5 ARG HD3 1 1 10 1221 1 1 5 ARG HE H 1.416 8.173 -0.654 1.00 . A A . 5 ARG HE 1 1 10 1222 1 1 5 ARG HG2 H 0.442 5.512 0.457 1.00 . A A . 5 ARG HG2 1 1 10 1223 1 1 5 ARG HG3 H 1.820 4.815 1.312 1.00 . A A . 5 ARG HG3 1 1 10 1224 1 1 5 ARG HH11 H 2.013 6.553 2.379 1.00 . A A . 5 ARG HH11 1 1 10 1225 1 1 5 ARG HH12 H 1.265 7.791 3.331 1.00 . A A . 5 ARG HH12 1 1 10 1226 1 1 5 ARG HH21 H 0.432 9.803 0.597 1.00 . A A . 5 ARG HH21 1 1 10 1227 1 1 5 ARG HH22 H 0.367 9.636 2.319 1.00 . A A . 5 ARG HH22 1 1 10 1228 1 1 5 ARG N N -0.066 2.688 -1.907 1.00 . A A . 5 ARG N 1 1 10 1229 1 1 5 ARG NE N 1.627 7.645 0.144 1.00 . A A . 5 ARG NE 1 1 10 1230 1 1 5 ARG NH1 N 1.538 7.430 2.439 1.00 . A A . 5 ARG NH1 1 1 10 1231 1 1 5 ARG NH2 N 0.637 9.281 1.424 1.00 . A A . 5 ARG NH2 1 1 10 1232 1 1 5 ARG O O 1.139 4.136 -3.907 1.00 . A A . 5 ARG O 1 1 10 1233 1 1 6 HIS C C 2.266 7.664 -3.874 1.00 . A A . 6 HIS C 1 1 10 1234 1 1 6 HIS CA C 0.967 6.896 -4.096 1.00 . A A . 6 HIS CA 1 1 10 1235 1 1 6 HIS CB C -0.167 7.871 -4.417 1.00 . A A . 6 HIS CB 1 1 10 1236 1 1 6 HIS CD2 C -1.352 8.410 -2.173 1.00 . A A . 6 HIS CD2 1 1 10 1237 1 1 6 HIS CE1 C -0.721 10.500 -1.972 1.00 . A A . 6 HIS CE1 1 1 10 1238 1 1 6 HIS CG C -0.584 8.708 -3.247 1.00 . A A . 6 HIS CG 1 1 10 1239 1 1 6 HIS H H 0.309 6.544 -2.115 1.00 . A A . 6 HIS H 1 1 10 1240 1 1 6 HIS HA H 1.098 6.223 -4.930 1.00 . A A . 6 HIS HA 1 1 10 1241 1 1 6 HIS HB2 H 0.154 8.540 -5.206 1.00 . A A . 6 HIS HB2 1 1 10 1242 1 1 6 HIS HB3 H -1.032 7.308 -4.750 1.00 . A A . 6 HIS HB3 1 1 10 1243 1 1 6 HIS HD1 H 0.359 10.535 -3.709 1.00 . A A . 6 HIS HD1 1 1 10 1244 1 1 6 HIS HD2 H -1.823 7.459 -1.965 1.00 . A A . 6 HIS HD2 1 1 10 1245 1 1 6 HIS HE1 H -0.593 11.503 -1.592 1.00 . A A . 6 HIS HE1 1 1 10 1246 1 1 6 HIS HE2 H -1.980 9.649 -0.598 1.00 . A A . 6 HIS HE2 1 1 10 1247 1 1 6 HIS N N 0.629 6.095 -2.925 1.00 . A A . 6 HIS N 1 1 10 1248 1 1 6 HIS ND1 N -0.205 10.025 -3.091 1.00 . A A . 6 HIS ND1 1 1 10 1249 1 1 6 HIS NE2 N -1.422 9.540 -1.396 1.00 . A A . 6 HIS NE2 1 1 10 1250 1 1 6 HIS O O 2.218 8.730 -3.226 1.00 . A A . 6 HIS O 1 1 11 1251 1 1 1 HIS C C -0.248 -6.660 2.624 1.00 . A A . 1 HIS C 1 1 11 1252 1 1 1 HIS CA C -0.087 -8.024 1.960 1.00 . A A . 1 HIS CA 1 1 11 1253 1 1 1 HIS CB C -0.850 -8.059 0.634 1.00 . A A . 1 HIS CB 1 1 11 1254 1 1 1 HIS CD2 C 0.417 -10.181 -0.156 1.00 . A A . 1 HIS CD2 1 1 11 1255 1 1 1 HIS CE1 C 0.121 -9.944 -2.316 1.00 . A A . 1 HIS CE1 1 1 11 1256 1 1 1 HIS CG C -0.301 -9.049 -0.347 1.00 . A A . 1 HIS CG 1 1 11 1257 1 1 1 HIS H1 H -0.236 -10.012 2.467 1.00 . A A . 1 HIS H1 1 1 11 1258 1 1 1 HIS H2 H -1.642 -9.083 2.791 1.00 . A A . 1 HIS H2 1 1 11 1259 1 1 1 HIS H3 H -0.261 -8.932 3.798 1.00 . A A . 1 HIS H3 1 1 11 1260 1 1 1 HIS HA H 0.962 -8.202 1.772 1.00 . A A . 1 HIS HA 1 1 11 1261 1 1 1 HIS HB2 H -1.879 -8.320 0.827 1.00 . A A . 1 HIS HB2 1 1 11 1262 1 1 1 HIS HB3 H -0.810 -7.081 0.178 1.00 . A A . 1 HIS HB3 1 1 11 1263 1 1 1 HIS HD1 H -0.950 -8.207 -2.166 1.00 . A A . 1 HIS HD1 1 1 11 1264 1 1 1 HIS HD2 H 0.736 -10.586 0.794 1.00 . A A . 1 HIS HD2 1 1 11 1265 1 1 1 HIS HE1 H 0.152 -10.112 -3.382 1.00 . A A . 1 HIS HE1 1 1 11 1266 1 1 1 HIS HE2 H 1.093 -11.583 -1.566 1.00 . A A . 1 HIS HE2 1 1 11 1267 1 1 1 HIS N N -0.603 -9.111 2.832 1.00 . A A . 1 HIS N 1 1 11 1268 1 1 1 HIS ND1 N -0.469 -8.929 -1.710 1.00 . A A . 1 HIS ND1 1 1 11 1269 1 1 1 HIS NE2 N 0.666 -10.718 -1.395 1.00 . A A . 1 HIS NE2 1 1 11 1270 1 1 1 HIS O O -0.837 -6.548 3.699 1.00 . A A . 1 HIS O 1 1 11 1271 1 1 2 ARG C C -0.674 -3.392 1.605 1.00 . A A . 2 ARG C 1 1 11 1272 1 1 2 ARG CA C 0.191 -4.269 2.503 1.00 . A A . 2 ARG CA 1 1 11 1273 1 1 2 ARG CB C 1.588 -3.661 2.636 1.00 . A A . 2 ARG CB 1 1 11 1274 1 1 2 ARG CD C 3.285 -5.147 3.744 1.00 . A A . 2 ARG CD 1 1 11 1275 1 1 2 ARG CG C 2.286 -4.018 3.938 1.00 . A A . 2 ARG CG 1 1 11 1276 1 1 2 ARG CZ C 4.583 -6.665 5.188 1.00 . A A . 2 ARG CZ 1 1 11 1277 1 1 2 ARG H H 0.735 -5.779 1.122 1.00 . A A . 2 ARG H 1 1 11 1278 1 1 2 ARG HA H -0.263 -4.322 3.481 1.00 . A A . 2 ARG HA 1 1 11 1279 1 1 2 ARG HB2 H 2.200 -4.010 1.817 1.00 . A A . 2 ARG HB2 1 1 11 1280 1 1 2 ARG HB3 H 1.506 -2.585 2.579 1.00 . A A . 2 ARG HB3 1 1 11 1281 1 1 2 ARG HD2 H 2.899 -5.828 2.999 1.00 . A A . 2 ARG HD2 1 1 11 1282 1 1 2 ARG HD3 H 4.219 -4.729 3.399 1.00 . A A . 2 ARG HD3 1 1 11 1283 1 1 2 ARG HE H 2.859 -5.797 5.697 1.00 . A A . 2 ARG HE 1 1 11 1284 1 1 2 ARG HG2 H 2.809 -3.148 4.305 1.00 . A A . 2 ARG HG2 1 1 11 1285 1 1 2 ARG HG3 H 1.544 -4.325 4.660 1.00 . A A . 2 ARG HG3 1 1 11 1286 1 1 2 ARG HH11 H 5.403 -6.334 3.369 1.00 . A A . 2 ARG HH11 1 1 11 1287 1 1 2 ARG HH12 H 6.296 -7.397 4.403 1.00 . A A . 2 ARG HH12 1 1 11 1288 1 1 2 ARG HH21 H 4.033 -7.195 7.059 1.00 . A A . 2 ARG HH21 1 1 11 1289 1 1 2 ARG HH22 H 5.518 -7.886 6.498 1.00 . A A . 2 ARG HH22 1 1 11 1290 1 1 2 ARG N N 0.278 -5.626 1.976 1.00 . A A . 2 ARG N 1 1 11 1291 1 1 2 ARG NE N 3.523 -5.886 4.982 1.00 . A A . 2 ARG NE 1 1 11 1292 1 1 2 ARG NH1 N 5.503 -6.810 4.242 1.00 . A A . 2 ARG NH1 1 1 11 1293 1 1 2 ARG NH2 N 4.723 -7.301 6.343 1.00 . A A . 2 ARG NH2 1 1 11 1294 1 1 2 ARG O O -1.149 -3.834 0.559 1.00 . A A . 2 ARG O 1 1 11 1295 1 1 3 PHE C C -0.870 -0.571 0.133 1.00 . A A . 3 PHE C 1 1 11 1296 1 1 3 PHE CA C -1.684 -1.206 1.253 1.00 . A A . 3 PHE CA 1 1 11 1297 1 1 3 PHE CB C -2.254 -0.124 2.167 1.00 . A A . 3 PHE CB 1 1 11 1298 1 1 3 PHE CD1 C -4.600 -0.904 1.681 1.00 . A A . 3 PHE CD1 1 1 11 1299 1 1 3 PHE CD2 C -4.231 1.419 2.076 1.00 . A A . 3 PHE CD2 1 1 11 1300 1 1 3 PHE CE1 C -5.949 -0.663 1.503 1.00 . A A . 3 PHE CE1 1 1 11 1301 1 1 3 PHE CE2 C -5.579 1.666 1.899 1.00 . A A . 3 PHE CE2 1 1 11 1302 1 1 3 PHE CG C -3.725 0.133 1.970 1.00 . A A . 3 PHE CG 1 1 11 1303 1 1 3 PHE CZ C -6.439 0.624 1.612 1.00 . A A . 3 PHE CZ 1 1 11 1304 1 1 3 PHE H H -0.470 -1.851 2.863 1.00 . A A . 3 PHE H 1 1 11 1305 1 1 3 PHE HA H -2.497 -1.752 0.816 1.00 . A A . 3 PHE HA 1 1 11 1306 1 1 3 PHE HB2 H -2.105 -0.417 3.199 1.00 . A A . 3 PHE HB2 1 1 11 1307 1 1 3 PHE HB3 H -1.729 0.798 1.975 1.00 . A A . 3 PHE HB3 1 1 11 1308 1 1 3 PHE HD1 H -4.218 -1.911 1.595 1.00 . A A . 3 PHE HD1 1 1 11 1309 1 1 3 PHE HD2 H -3.560 2.235 2.300 1.00 . A A . 3 PHE HD2 1 1 11 1310 1 1 3 PHE HE1 H -6.619 -1.479 1.279 1.00 . A A . 3 PHE HE1 1 1 11 1311 1 1 3 PHE HE2 H -5.960 2.673 1.984 1.00 . A A . 3 PHE HE2 1 1 11 1312 1 1 3 PHE HZ H -7.493 0.815 1.473 1.00 . A A . 3 PHE HZ 1 1 11 1313 1 1 3 PHE N N -0.876 -2.146 2.021 1.00 . A A . 3 PHE N 1 1 11 1314 1 1 3 PHE O O 0.349 -0.729 0.069 1.00 . A A . 3 PHE O 1 1 11 1315 1 1 4 LEU C C -0.685 2.281 -1.603 1.00 . A A . 4 LEU C 1 1 11 1316 1 1 4 LEU CA C -0.902 0.797 -1.878 1.00 . A A . 4 LEU CA 1 1 11 1317 1 1 4 LEU CB C -1.726 0.615 -3.151 1.00 . A A . 4 LEU CB 1 1 11 1318 1 1 4 LEU CD1 C -3.757 -0.676 -2.492 1.00 . A A . 4 LEU CD1 1 1 11 1319 1 1 4 LEU CD2 C -2.684 -1.098 -4.712 1.00 . A A . 4 LEU CD2 1 1 11 1320 1 1 4 LEU CG C -2.449 -0.726 -3.255 1.00 . A A . 4 LEU CG 1 1 11 1321 1 1 4 LEU H H -2.524 0.226 -0.651 1.00 . A A . 4 LEU H 1 1 11 1322 1 1 4 LEU HA H 0.053 0.323 -2.016 1.00 . A A . 4 LEU HA 1 1 11 1323 1 1 4 LEU HB2 H -2.463 1.405 -3.195 1.00 . A A . 4 LEU HB2 1 1 11 1324 1 1 4 LEU HB3 H -1.067 0.711 -4.001 1.00 . A A . 4 LEU HB3 1 1 11 1325 1 1 4 LEU HD11 H -4.048 0.354 -2.348 1.00 . A A . 4 LEU HD11 1 1 11 1326 1 1 4 LEU HD12 H -3.625 -1.149 -1.531 1.00 . A A . 4 LEU HD12 1 1 11 1327 1 1 4 LEU HD13 H -4.523 -1.194 -3.049 1.00 . A A . 4 LEU HD13 1 1 11 1328 1 1 4 LEU HD21 H -2.960 -2.140 -4.777 1.00 . A A . 4 LEU HD21 1 1 11 1329 1 1 4 LEU HD22 H -1.779 -0.930 -5.277 1.00 . A A . 4 LEU HD22 1 1 11 1330 1 1 4 LEU HD23 H -3.479 -0.489 -5.115 1.00 . A A . 4 LEU HD23 1 1 11 1331 1 1 4 LEU HG H -1.835 -1.491 -2.804 1.00 . A A . 4 LEU HG 1 1 11 1332 1 1 4 LEU N N -1.556 0.142 -0.753 1.00 . A A . 4 LEU N 1 1 11 1333 1 1 4 LEU O O -1.549 2.950 -1.037 1.00 . A A . 4 LEU O 1 1 11 1334 1 1 5 ARG C C 1.035 4.897 -3.143 1.00 . A A . 5 ARG C 1 1 11 1335 1 1 5 ARG CA C 0.805 4.196 -1.808 1.00 . A A . 5 ARG CA 1 1 11 1336 1 1 5 ARG CB C 2.048 4.329 -0.928 1.00 . A A . 5 ARG CB 1 1 11 1337 1 1 5 ARG CD C 2.738 6.718 -0.556 1.00 . A A . 5 ARG CD 1 1 11 1338 1 1 5 ARG CG C 1.996 5.520 0.015 1.00 . A A . 5 ARG CG 1 1 11 1339 1 1 5 ARG CZ C 1.852 8.655 0.683 1.00 . A A . 5 ARG CZ 1 1 11 1340 1 1 5 ARG H H 1.122 2.206 -2.455 1.00 . A A . 5 ARG H 1 1 11 1341 1 1 5 ARG HA H -0.030 4.665 -1.308 1.00 . A A . 5 ARG HA 1 1 11 1342 1 1 5 ARG HB2 H 2.153 3.430 -0.333 1.00 . A A . 5 ARG HB2 1 1 11 1343 1 1 5 ARG HB3 H 2.917 4.440 -1.566 1.00 . A A . 5 ARG HB3 1 1 11 1344 1 1 5 ARG HD2 H 3.667 6.839 -0.019 1.00 . A A . 5 ARG HD2 1 1 11 1345 1 1 5 ARG HD3 H 2.948 6.533 -1.599 1.00 . A A . 5 ARG HD3 1 1 11 1346 1 1 5 ARG HE H 1.495 8.268 -1.242 1.00 . A A . 5 ARG HE 1 1 11 1347 1 1 5 ARG HG2 H 0.964 5.794 0.177 1.00 . A A . 5 ARG HG2 1 1 11 1348 1 1 5 ARG HG3 H 2.448 5.242 0.955 1.00 . A A . 5 ARG HG3 1 1 11 1349 1 1 5 ARG HH11 H 3.021 7.422 1.781 1.00 . A A . 5 ARG HH11 1 1 11 1350 1 1 5 ARG HH12 H 2.384 8.790 2.629 1.00 . A A . 5 ARG HH12 1 1 11 1351 1 1 5 ARG HH21 H 0.656 10.068 -0.128 1.00 . A A . 5 ARG HH21 1 1 11 1352 1 1 5 ARG HH22 H 1.040 10.293 1.546 1.00 . A A . 5 ARG HH22 1 1 11 1353 1 1 5 ARG N N 0.474 2.790 -2.009 1.00 . A A . 5 ARG N 1 1 11 1354 1 1 5 ARG NE N 1.961 7.950 -0.440 1.00 . A A . 5 ARG NE 1 1 11 1355 1 1 5 ARG NH1 N 2.469 8.256 1.788 1.00 . A A . 5 ARG NH1 1 1 11 1356 1 1 5 ARG NH2 N 1.123 9.763 0.702 1.00 . A A . 5 ARG NH2 1 1 11 1357 1 1 5 ARG O O 1.703 4.363 -4.028 1.00 . A A . 5 ARG O 1 1 11 1358 1 1 6 HIS C C 1.036 8.303 -4.202 1.00 . A A . 6 HIS C 1 1 11 1359 1 1 6 HIS CA C 0.620 6.868 -4.509 1.00 . A A . 6 HIS CA 1 1 11 1360 1 1 6 HIS CB C -0.690 6.863 -5.297 1.00 . A A . 6 HIS CB 1 1 11 1361 1 1 6 HIS CD2 C -1.895 8.045 -3.328 1.00 . A A . 6 HIS CD2 1 1 11 1362 1 1 6 HIS CE1 C -3.929 8.041 -4.148 1.00 . A A . 6 HIS CE1 1 1 11 1363 1 1 6 HIS CG C -1.843 7.449 -4.543 1.00 . A A . 6 HIS CG 1 1 11 1364 1 1 6 HIS H H -0.046 6.467 -2.540 1.00 . A A . 6 HIS H 1 1 11 1365 1 1 6 HIS HA H 1.391 6.402 -5.105 1.00 . A A . 6 HIS HA 1 1 11 1366 1 1 6 HIS HB2 H -0.560 7.441 -6.204 1.00 . A A . 6 HIS HB2 1 1 11 1367 1 1 6 HIS HB3 H -0.944 5.840 -5.554 1.00 . A A . 6 HIS HB3 1 1 11 1368 1 1 6 HIS HD1 H -3.423 7.099 -5.893 1.00 . A A . 6 HIS HD1 1 1 11 1369 1 1 6 HIS HD2 H -1.063 8.209 -2.657 1.00 . A A . 6 HIS HD2 1 1 11 1370 1 1 6 HIS HE1 H -4.992 8.191 -4.259 1.00 . A A . 6 HIS HE1 1 1 11 1371 1 1 6 HIS HE2 H -3.557 8.776 -2.273 1.00 . A A . 6 HIS HE2 1 1 11 1372 1 1 6 HIS N N 0.476 6.095 -3.281 1.00 . A A . 6 HIS N 1 1 11 1373 1 1 6 HIS ND1 N -3.133 7.461 -5.029 1.00 . A A . 6 HIS ND1 1 1 11 1374 1 1 6 HIS NE2 N -3.202 8.403 -3.107 1.00 . A A . 6 HIS NE2 1 1 11 1375 1 1 6 HIS O O 1.158 8.640 -3.006 1.00 . A A . 6 HIS O 1 1 12 1376 1 1 1 HIS C C 0.049 -6.476 2.813 1.00 . A A . 1 HIS C 1 1 12 1377 1 1 1 HIS CA C -0.327 -7.948 2.672 1.00 . A A . 1 HIS CA 1 1 12 1378 1 1 1 HIS CB C -1.769 -8.079 2.179 1.00 . A A . 1 HIS CB 1 1 12 1379 1 1 1 HIS CD2 C -2.250 -10.573 2.706 1.00 . A A . 1 HIS CD2 1 1 12 1380 1 1 1 HIS CE1 C -2.876 -11.209 0.704 1.00 . A A . 1 HIS CE1 1 1 12 1381 1 1 1 HIS CG C -2.179 -9.491 1.895 1.00 . A A . 1 HIS CG 1 1 12 1382 1 1 1 HIS H1 H 0.671 -8.336 4.428 1.00 . A A . 1 HIS H1 1 1 12 1383 1 1 1 HIS H2 H -0.167 -9.681 3.769 1.00 . A A . 1 HIS H2 1 1 12 1384 1 1 1 HIS H3 H -1.037 -8.421 4.544 1.00 . A A . 1 HIS H3 1 1 12 1385 1 1 1 HIS HA H 0.336 -8.414 1.959 1.00 . A A . 1 HIS HA 1 1 12 1386 1 1 1 HIS HB2 H -2.437 -7.685 2.930 1.00 . A A . 1 HIS HB2 1 1 12 1387 1 1 1 HIS HB3 H -1.884 -7.509 1.268 1.00 . A A . 1 HIS HB3 1 1 12 1388 1 1 1 HIS HD1 H -2.633 -9.369 -0.159 1.00 . A A . 1 HIS HD1 1 1 12 1389 1 1 1 HIS HD2 H -2.008 -10.602 3.759 1.00 . A A . 1 HIS HD2 1 1 12 1390 1 1 1 HIS HE1 H -3.217 -11.815 -0.122 1.00 . A A . 1 HIS HE1 1 1 12 1391 1 1 1 HIS HE2 H -2.913 -12.519 2.278 1.00 . A A . 1 HIS HE2 1 1 12 1392 1 1 1 HIS N N -0.204 -8.661 3.970 1.00 . A A . 1 HIS N 1 1 12 1393 1 1 1 HIS ND1 N -2.577 -9.923 0.647 1.00 . A A . 1 HIS ND1 1 1 12 1394 1 1 1 HIS NE2 N -2.685 -11.627 1.941 1.00 . A A . 1 HIS NE2 1 1 12 1395 1 1 1 HIS O O 0.168 -5.960 3.924 1.00 . A A . 1 HIS O 1 1 12 1396 1 1 2 ARG C C -0.534 -3.544 1.109 1.00 . A A . 2 ARG C 1 1 12 1397 1 1 2 ARG CA C 0.596 -4.394 1.677 1.00 . A A . 2 ARG CA 1 1 12 1398 1 1 2 ARG CB C 1.874 -4.176 0.865 1.00 . A A . 2 ARG CB 1 1 12 1399 1 1 2 ARG CD C 3.943 -2.800 0.487 1.00 . A A . 2 ARG CD 1 1 12 1400 1 1 2 ARG CG C 2.638 -2.922 1.258 1.00 . A A . 2 ARG CG 1 1 12 1401 1 1 2 ARG CZ C 6.140 -1.735 0.816 1.00 . A A . 2 ARG CZ 1 1 12 1402 1 1 2 ARG H H 0.124 -6.274 0.826 1.00 . A A . 2 ARG H 1 1 12 1403 1 1 2 ARG HA H 0.775 -4.096 2.699 1.00 . A A . 2 ARG HA 1 1 12 1404 1 1 2 ARG HB2 H 2.525 -5.026 1.003 1.00 . A A . 2 ARG HB2 1 1 12 1405 1 1 2 ARG HB3 H 1.613 -4.099 -0.181 1.00 . A A . 2 ARG HB3 1 1 12 1406 1 1 2 ARG HD2 H 4.236 -3.781 0.144 1.00 . A A . 2 ARG HD2 1 1 12 1407 1 1 2 ARG HD3 H 3.784 -2.155 -0.364 1.00 . A A . 2 ARG HD3 1 1 12 1408 1 1 2 ARG HE H 4.891 -2.256 2.282 1.00 . A A . 2 ARG HE 1 1 12 1409 1 1 2 ARG HG2 H 2.026 -2.058 1.048 1.00 . A A . 2 ARG HG2 1 1 12 1410 1 1 2 ARG HG3 H 2.857 -2.962 2.315 1.00 . A A . 2 ARG HG3 1 1 12 1411 1 1 2 ARG HH11 H 5.651 -2.067 -1.118 1.00 . A A . 2 ARG HH11 1 1 12 1412 1 1 2 ARG HH12 H 7.191 -1.318 -0.860 1.00 . A A . 2 ARG HH12 1 1 12 1413 1 1 2 ARG HH21 H 6.916 -1.271 2.624 1.00 . A A . 2 ARG HH21 1 1 12 1414 1 1 2 ARG HH22 H 7.910 -0.867 1.264 1.00 . A A . 2 ARG HH22 1 1 12 1415 1 1 2 ARG N N 0.234 -5.807 1.680 1.00 . A A . 2 ARG N 1 1 12 1416 1 1 2 ARG NE N 5.015 -2.246 1.310 1.00 . A A . 2 ARG NE 1 1 12 1417 1 1 2 ARG NH1 N 6.344 -1.704 -0.495 1.00 . A A . 2 ARG NH1 1 1 12 1418 1 1 2 ARG NH2 N 7.064 -1.251 1.635 1.00 . A A . 2 ARG NH2 1 1 12 1419 1 1 2 ARG O O -1.403 -4.045 0.395 1.00 . A A . 2 ARG O 1 1 12 1420 1 1 3 PHE C C -1.059 -0.560 -0.266 1.00 . A A . 3 PHE C 1 1 12 1421 1 1 3 PHE CA C -1.542 -1.335 0.953 1.00 . A A . 3 PHE CA 1 1 12 1422 1 1 3 PHE CB C -1.954 -0.370 2.064 1.00 . A A . 3 PHE CB 1 1 12 1423 1 1 3 PHE CD1 C -4.258 -1.391 2.093 1.00 . A A . 3 PHE CD1 1 1 12 1424 1 1 3 PHE CD2 C -4.023 0.908 2.686 1.00 . A A . 3 PHE CD2 1 1 12 1425 1 1 3 PHE CE1 C -5.622 -1.308 2.298 1.00 . A A . 3 PHE CE1 1 1 12 1426 1 1 3 PHE CE2 C -5.387 0.996 2.892 1.00 . A A . 3 PHE CE2 1 1 12 1427 1 1 3 PHE CG C -3.442 -0.285 2.284 1.00 . A A . 3 PHE CG 1 1 12 1428 1 1 3 PHE CZ C -6.187 -0.113 2.698 1.00 . A A . 3 PHE CZ 1 1 12 1429 1 1 3 PHE H H 0.201 -1.915 2.005 1.00 . A A . 3 PHE H 1 1 12 1430 1 1 3 PHE HA H -2.397 -1.917 0.666 1.00 . A A . 3 PHE HA 1 1 12 1431 1 1 3 PHE HB2 H -1.499 -0.686 2.994 1.00 . A A . 3 PHE HB2 1 1 12 1432 1 1 3 PHE HB3 H -1.601 0.618 1.808 1.00 . A A . 3 PHE HB3 1 1 12 1433 1 1 3 PHE HD1 H -3.818 -2.326 1.779 1.00 . A A . 3 PHE HD1 1 1 12 1434 1 1 3 PHE HD2 H -3.399 1.776 2.838 1.00 . A A . 3 PHE HD2 1 1 12 1435 1 1 3 PHE HE1 H -6.246 -2.176 2.146 1.00 . A A . 3 PHE HE1 1 1 12 1436 1 1 3 PHE HE2 H -5.826 1.932 3.205 1.00 . A A . 3 PHE HE2 1 1 12 1437 1 1 3 PHE HZ H -7.253 -0.045 2.859 1.00 . A A . 3 PHE HZ 1 1 12 1438 1 1 3 PHE N N -0.517 -2.255 1.431 1.00 . A A . 3 PHE N 1 1 12 1439 1 1 3 PHE O O 0.117 -0.614 -0.626 1.00 . A A . 3 PHE O 1 1 12 1440 1 1 4 LEU C C -1.297 2.371 -1.721 1.00 . A A . 4 LEU C 1 1 12 1441 1 1 4 LEU CA C -1.657 0.935 -2.088 1.00 . A A . 4 LEU CA 1 1 12 1442 1 1 4 LEU CB C -2.828 0.922 -3.069 1.00 . A A . 4 LEU CB 1 1 12 1443 1 1 4 LEU CD1 C -4.608 -0.536 -2.095 1.00 . A A . 4 LEU CD1 1 1 12 1444 1 1 4 LEU CD2 C -4.169 -0.585 -4.559 1.00 . A A . 4 LEU CD2 1 1 12 1445 1 1 4 LEU CG C -3.552 -0.419 -3.178 1.00 . A A . 4 LEU CG 1 1 12 1446 1 1 4 LEU H H -2.899 0.151 -0.568 1.00 . A A . 4 LEU H 1 1 12 1447 1 1 4 LEU HA H -0.809 0.472 -2.559 1.00 . A A . 4 LEU HA 1 1 12 1448 1 1 4 LEU HB2 H -3.542 1.671 -2.757 1.00 . A A . 4 LEU HB2 1 1 12 1449 1 1 4 LEU HB3 H -2.457 1.186 -4.047 1.00 . A A . 4 LEU HB3 1 1 12 1450 1 1 4 LEU HD11 H -4.368 -1.370 -1.453 1.00 . A A . 4 LEU HD11 1 1 12 1451 1 1 4 LEU HD12 H -5.576 -0.692 -2.546 1.00 . A A . 4 LEU HD12 1 1 12 1452 1 1 4 LEU HD13 H -4.622 0.372 -1.511 1.00 . A A . 4 LEU HD13 1 1 12 1453 1 1 4 LEU HD21 H -5.103 -1.121 -4.474 1.00 . A A . 4 LEU HD21 1 1 12 1454 1 1 4 LEU HD22 H -3.492 -1.138 -5.192 1.00 . A A . 4 LEU HD22 1 1 12 1455 1 1 4 LEU HD23 H -4.351 0.389 -4.991 1.00 . A A . 4 LEU HD23 1 1 12 1456 1 1 4 LEU HG H -2.839 -1.217 -3.029 1.00 . A A . 4 LEU HG 1 1 12 1457 1 1 4 LEU N N -1.980 0.154 -0.903 1.00 . A A . 4 LEU N 1 1 12 1458 1 1 4 LEU O O -2.123 3.111 -1.186 1.00 . A A . 4 LEU O 1 1 12 1459 1 1 5 ARG C C 0.880 4.812 -2.979 1.00 . A A . 5 ARG C 1 1 12 1460 1 1 5 ARG CA C 0.412 4.105 -1.711 1.00 . A A . 5 ARG CA 1 1 12 1461 1 1 5 ARG CB C 1.551 4.055 -0.691 1.00 . A A . 5 ARG CB 1 1 12 1462 1 1 5 ARG CD C 2.586 6.296 -0.221 1.00 . A A . 5 ARG CD 1 1 12 1463 1 1 5 ARG CG C 1.581 5.254 0.243 1.00 . A A . 5 ARG CG 1 1 12 1464 1 1 5 ARG CZ C 2.122 8.269 1.182 1.00 . A A . 5 ARG CZ 1 1 12 1465 1 1 5 ARG H H 0.553 2.122 -2.437 1.00 . A A . 5 ARG H 1 1 12 1466 1 1 5 ARG HA H -0.414 4.658 -1.289 1.00 . A A . 5 ARG HA 1 1 12 1467 1 1 5 ARG HB2 H 1.441 3.160 -0.090 1.00 . A A . 5 ARG HB2 1 1 12 1468 1 1 5 ARG HB3 H 2.494 4.015 -1.224 1.00 . A A . 5 ARG HB3 1 1 12 1469 1 1 5 ARG HD2 H 3.507 6.159 0.326 1.00 . A A . 5 ARG HD2 1 1 12 1470 1 1 5 ARG HD3 H 2.770 6.156 -1.276 1.00 . A A . 5 ARG HD3 1 1 12 1471 1 1 5 ARG HE H 1.747 8.142 -0.774 1.00 . A A . 5 ARG HE 1 1 12 1472 1 1 5 ARG HG2 H 0.599 5.702 0.270 1.00 . A A . 5 ARG HG2 1 1 12 1473 1 1 5 ARG HG3 H 1.853 4.919 1.233 1.00 . A A . 5 ARG HG3 1 1 12 1474 1 1 5 ARG HH11 H 2.945 6.710 2.174 1.00 . A A . 5 ARG HH11 1 1 12 1475 1 1 5 ARG HH12 H 2.609 8.109 3.138 1.00 . A A . 5 ARG HH12 1 1 12 1476 1 1 5 ARG HH21 H 1.304 9.983 0.491 1.00 . A A . 5 ARG HH21 1 1 12 1477 1 1 5 ARG HH22 H 1.677 9.967 2.183 1.00 . A A . 5 ARG HH22 1 1 12 1478 1 1 5 ARG N N -0.059 2.758 -2.011 1.00 . A A . 5 ARG N 1 1 12 1479 1 1 5 ARG NE N 2.103 7.658 -0.001 1.00 . A A . 5 ARG NE 1 1 12 1480 1 1 5 ARG NH1 N 2.597 7.644 2.252 1.00 . A A . 5 ARG NH1 1 1 12 1481 1 1 5 ARG NH2 N 1.664 9.508 1.295 1.00 . A A . 5 ARG NH2 1 1 12 1482 1 1 5 ARG O O 1.380 4.177 -3.907 1.00 . A A . 5 ARG O 1 1 12 1483 1 1 6 HIS C C 1.906 8.155 -3.730 1.00 . A A . 6 HIS C 1 1 12 1484 1 1 6 HIS CA C 1.119 6.923 -4.166 1.00 . A A . 6 HIS CA 1 1 12 1485 1 1 6 HIS CB C -0.108 7.348 -4.975 1.00 . A A . 6 HIS CB 1 1 12 1486 1 1 6 HIS CD2 C -1.974 7.691 -3.206 1.00 . A A . 6 HIS CD2 1 1 12 1487 1 1 6 HIS CE1 C -2.289 9.843 -3.485 1.00 . A A . 6 HIS CE1 1 1 12 1488 1 1 6 HIS CG C -1.120 8.105 -4.173 1.00 . A A . 6 HIS CG 1 1 12 1489 1 1 6 HIS H H 0.308 6.580 -2.241 1.00 . A A . 6 HIS H 1 1 12 1490 1 1 6 HIS HA H 1.752 6.307 -4.786 1.00 . A A . 6 HIS HA 1 1 12 1491 1 1 6 HIS HB2 H 0.211 7.985 -5.792 1.00 . A A . 6 HIS HB2 1 1 12 1492 1 1 6 HIS HB3 H -0.591 6.464 -5.374 1.00 . A A . 6 HIS HB3 1 1 12 1493 1 1 6 HIS HD1 H -0.877 10.048 -4.952 1.00 . A A . 6 HIS HD1 1 1 12 1494 1 1 6 HIS HD2 H -2.074 6.683 -2.828 1.00 . A A . 6 HIS HD2 1 1 12 1495 1 1 6 HIS HE1 H -2.671 10.847 -3.382 1.00 . A A . 6 HIS HE1 1 1 12 1496 1 1 6 HIS HE2 H -3.440 8.778 -2.168 1.00 . A A . 6 HIS HE2 1 1 12 1497 1 1 6 HIS N N 0.713 6.130 -3.011 1.00 . A A . 6 HIS N 1 1 12 1498 1 1 6 HIS ND1 N -1.343 9.457 -4.324 1.00 . A A . 6 HIS ND1 1 1 12 1499 1 1 6 HIS NE2 N -2.688 8.790 -2.796 1.00 . A A . 6 HIS NE2 1 1 12 1500 1 1 6 HIS O O 1.717 8.600 -2.579 1.00 . A A . 6 HIS O 1 1 13 1501 1 1 1 HIS C C -0.779 -6.672 2.628 1.00 . A A . 1 HIS C 1 1 13 1502 1 1 1 HIS CA C -0.857 -8.079 2.044 1.00 . A A . 1 HIS CA 1 1 13 1503 1 1 1 HIS CB C -2.297 -8.405 1.643 1.00 . A A . 1 HIS CB 1 1 13 1504 1 1 1 HIS CD2 C -2.910 -6.153 0.511 1.00 . A A . 1 HIS CD2 1 1 13 1505 1 1 1 HIS CE1 C -3.787 -6.949 -1.334 1.00 . A A . 1 HIS CE1 1 1 13 1506 1 1 1 HIS CG C -2.840 -7.503 0.578 1.00 . A A . 1 HIS CG 1 1 13 1507 1 1 1 HIS H1 H 0.603 -8.906 3.233 1.00 . A A . 1 HIS H1 1 1 13 1508 1 1 1 HIS H2 H -0.522 -10.033 2.593 1.00 . A A . 1 HIS H2 1 1 13 1509 1 1 1 HIS H3 H -0.981 -8.996 3.881 1.00 . A A . 1 HIS H3 1 1 13 1510 1 1 1 HIS HA H -0.224 -8.134 1.171 1.00 . A A . 1 HIS HA 1 1 13 1511 1 1 1 HIS HB2 H -2.340 -9.418 1.273 1.00 . A A . 1 HIS HB2 1 1 13 1512 1 1 1 HIS HB3 H -2.934 -8.317 2.511 1.00 . A A . 1 HIS HB3 1 1 13 1513 1 1 1 HIS HD1 H -3.495 -8.915 -0.844 1.00 . A A . 1 HIS HD1 1 1 13 1514 1 1 1 HIS HD2 H -2.564 -5.455 1.260 1.00 . A A . 1 HIS HD2 1 1 13 1515 1 1 1 HIS HE1 H -4.258 -7.014 -2.304 1.00 . A A . 1 HIS HE1 1 1 13 1516 1 1 1 HIS HE2 H -3.763 -4.934 -0.971 1.00 . A A . 1 HIS HE2 1 1 13 1517 1 1 1 HIS N N -0.398 -9.095 3.026 1.00 . A A . 1 HIS N 1 1 13 1518 1 1 1 HIS ND1 N -3.398 -7.972 -0.593 1.00 . A A . 1 HIS ND1 1 1 13 1519 1 1 1 HIS NE2 N -3.502 -5.835 -0.687 1.00 . A A . 1 HIS NE2 1 1 13 1520 1 1 1 HIS O O -1.426 -6.369 3.630 1.00 . A A . 1 HIS O 1 1 13 1521 1 1 2 ARG C C -0.590 -3.477 1.556 1.00 . A A . 2 ARG C 1 1 13 1522 1 1 2 ARG CA C 0.180 -4.442 2.451 1.00 . A A . 2 ARG CA 1 1 13 1523 1 1 2 ARG CB C 1.661 -4.063 2.475 1.00 . A A . 2 ARG CB 1 1 13 1524 1 1 2 ARG CD C 3.817 -5.091 3.257 1.00 . A A . 2 ARG CD 1 1 13 1525 1 1 2 ARG CG C 2.420 -4.645 3.656 1.00 . A A . 2 ARG CG 1 1 13 1526 1 1 2 ARG CZ C 5.233 -4.558 5.202 1.00 . A A . 2 ARG CZ 1 1 13 1527 1 1 2 ARG H H 0.507 -6.118 1.200 1.00 . A A . 2 ARG H 1 1 13 1528 1 1 2 ARG HA H -0.215 -4.377 3.454 1.00 . A A . 2 ARG HA 1 1 13 1529 1 1 2 ARG HB2 H 2.126 -4.416 1.566 1.00 . A A . 2 ARG HB2 1 1 13 1530 1 1 2 ARG HB3 H 1.745 -2.987 2.516 1.00 . A A . 2 ARG HB3 1 1 13 1531 1 1 2 ARG HD2 H 3.735 -5.951 2.609 1.00 . A A . 2 ARG HD2 1 1 13 1532 1 1 2 ARG HD3 H 4.300 -4.285 2.725 1.00 . A A . 2 ARG HD3 1 1 13 1533 1 1 2 ARG HE H 4.733 -6.401 4.622 1.00 . A A . 2 ARG HE 1 1 13 1534 1 1 2 ARG HG2 H 2.500 -3.893 4.427 1.00 . A A . 2 ARG HG2 1 1 13 1535 1 1 2 ARG HG3 H 1.874 -5.497 4.037 1.00 . A A . 2 ARG HG3 1 1 13 1536 1 1 2 ARG HH11 H 4.574 -2.943 4.178 1.00 . A A . 2 ARG HH11 1 1 13 1537 1 1 2 ARG HH12 H 5.571 -2.595 5.550 1.00 . A A . 2 ARG HH12 1 1 13 1538 1 1 2 ARG HH21 H 6.045 -5.945 6.427 1.00 . A A . 2 ARG HH21 1 1 13 1539 1 1 2 ARG HH22 H 6.407 -4.299 6.827 1.00 . A A . 2 ARG HH22 1 1 13 1540 1 1 2 ARG N N 0.017 -5.817 1.994 1.00 . A A . 2 ARG N 1 1 13 1541 1 1 2 ARG NE N 4.630 -5.448 4.417 1.00 . A A . 2 ARG NE 1 1 13 1542 1 1 2 ARG NH1 N 5.116 -3.259 4.956 1.00 . A A . 2 ARG NH1 1 1 13 1543 1 1 2 ARG NH2 N 5.954 -4.968 6.237 1.00 . A A . 2 ARG NH2 1 1 13 1544 1 1 2 ARG O O -1.057 -3.851 0.480 1.00 . A A . 2 ARG O 1 1 13 1545 1 1 3 PHE C C -0.543 -0.619 0.162 1.00 . A A . 3 PHE C 1 1 13 1546 1 1 3 PHE CA C -1.433 -1.215 1.246 1.00 . A A . 3 PHE CA 1 1 13 1547 1 1 3 PHE CB C -1.942 -0.114 2.176 1.00 . A A . 3 PHE CB 1 1 13 1548 1 1 3 PHE CD1 C -4.315 -0.853 1.771 1.00 . A A . 3 PHE CD1 1 1 13 1549 1 1 3 PHE CD2 C -3.900 1.457 2.196 1.00 . A A . 3 PHE CD2 1 1 13 1550 1 1 3 PHE CE1 C -5.667 -0.591 1.652 1.00 . A A . 3 PHE CE1 1 1 13 1551 1 1 3 PHE CE2 C -5.250 1.725 2.078 1.00 . A A . 3 PHE CE2 1 1 13 1552 1 1 3 PHE CG C -3.415 0.167 2.043 1.00 . A A . 3 PHE CG 1 1 13 1553 1 1 3 PHE CZ C -6.135 0.700 1.806 1.00 . A A . 3 PHE CZ 1 1 13 1554 1 1 3 PHE H H -0.326 -1.996 2.872 1.00 . A A . 3 PHE H 1 1 13 1555 1 1 3 PHE HA H -2.275 -1.686 0.774 1.00 . A A . 3 PHE HA 1 1 13 1556 1 1 3 PHE HB2 H -1.750 -0.401 3.203 1.00 . A A . 3 PHE HB2 1 1 13 1557 1 1 3 PHE HB3 H -1.410 0.799 1.952 1.00 . A A . 3 PHE HB3 1 1 13 1558 1 1 3 PHE HD1 H -3.952 -1.862 1.649 1.00 . A A . 3 PHE HD1 1 1 13 1559 1 1 3 PHE HD2 H -3.209 2.260 2.408 1.00 . A A . 3 PHE HD2 1 1 13 1560 1 1 3 PHE HE1 H -6.357 -1.394 1.439 1.00 . A A . 3 PHE HE1 1 1 13 1561 1 1 3 PHE HE2 H -5.614 2.735 2.198 1.00 . A A . 3 PHE HE2 1 1 13 1562 1 1 3 PHE HZ H -7.191 0.907 1.713 1.00 . A A . 3 PHE HZ 1 1 13 1563 1 1 3 PHE N N -0.720 -2.234 2.007 1.00 . A A . 3 PHE N 1 1 13 1564 1 1 3 PHE O O 0.661 -0.872 0.122 1.00 . A A . 3 PHE O 1 1 13 1565 1 1 4 LEU C C -0.241 2.293 -1.567 1.00 . A A . 4 LEU C 1 1 13 1566 1 1 4 LEU CA C -0.416 0.798 -1.811 1.00 . A A . 4 LEU CA 1 1 13 1567 1 1 4 LEU CB C -1.131 0.564 -3.142 1.00 . A A . 4 LEU CB 1 1 13 1568 1 1 4 LEU CD1 C -3.288 -0.543 -2.557 1.00 . A A . 4 LEU CD1 1 1 13 1569 1 1 4 LEU CD2 C -2.090 -1.189 -4.658 1.00 . A A . 4 LEU CD2 1 1 13 1570 1 1 4 LEU CG C -1.935 -0.732 -3.214 1.00 . A A . 4 LEU CG 1 1 13 1571 1 1 4 LEU H H -2.110 0.328 -0.636 1.00 . A A . 4 LEU H 1 1 13 1572 1 1 4 LEU HA H 0.552 0.336 -1.857 1.00 . A A . 4 LEU HA 1 1 13 1573 1 1 4 LEU HB2 H -1.802 1.392 -3.318 1.00 . A A . 4 LEU HB2 1 1 13 1574 1 1 4 LEU HB3 H -0.391 0.547 -3.928 1.00 . A A . 4 LEU HB3 1 1 13 1575 1 1 4 LEU HD11 H -4.069 -0.658 -3.293 1.00 . A A . 4 LEU HD11 1 1 13 1576 1 1 4 LEU HD12 H -3.339 0.446 -2.126 1.00 . A A . 4 LEU HD12 1 1 13 1577 1 1 4 LEU HD13 H -3.413 -1.280 -1.779 1.00 . A A . 4 LEU HD13 1 1 13 1578 1 1 4 LEU HD21 H -3.043 -1.682 -4.779 1.00 . A A . 4 LEU HD21 1 1 13 1579 1 1 4 LEU HD22 H -1.295 -1.878 -4.905 1.00 . A A . 4 LEU HD22 1 1 13 1580 1 1 4 LEU HD23 H -2.041 -0.333 -5.314 1.00 . A A . 4 LEU HD23 1 1 13 1581 1 1 4 LEU HG H -1.409 -1.503 -2.669 1.00 . A A . 4 LEU HG 1 1 13 1582 1 1 4 LEU N N -1.148 0.169 -0.720 1.00 . A A . 4 LEU N 1 1 13 1583 1 1 4 LEU O O -1.058 2.921 -0.895 1.00 . A A . 4 LEU O 1 1 13 1584 1 1 5 ARG C C 1.006 5.006 -3.296 1.00 . A A . 5 ARG C 1 1 13 1585 1 1 5 ARG CA C 1.111 4.279 -1.960 1.00 . A A . 5 ARG CA 1 1 13 1586 1 1 5 ARG CB C 2.506 4.481 -1.365 1.00 . A A . 5 ARG CB 1 1 13 1587 1 1 5 ARG CD C 3.377 6.831 -1.546 1.00 . A A . 5 ARG CD 1 1 13 1588 1 1 5 ARG CG C 2.676 5.816 -0.659 1.00 . A A . 5 ARG CG 1 1 13 1589 1 1 5 ARG CZ C 5.616 6.904 -0.519 1.00 . A A . 5 ARG CZ 1 1 13 1590 1 1 5 ARG H H 1.444 2.303 -2.643 1.00 . A A . 5 ARG H 1 1 13 1591 1 1 5 ARG HA H 0.378 4.689 -1.281 1.00 . A A . 5 ARG HA 1 1 13 1592 1 1 5 ARG HB2 H 2.697 3.691 -0.648 1.00 . A A . 5 ARG HB2 1 1 13 1593 1 1 5 ARG HB3 H 3.237 4.423 -2.163 1.00 . A A . 5 ARG HB3 1 1 13 1594 1 1 5 ARG HD2 H 3.003 6.727 -2.554 1.00 . A A . 5 ARG HD2 1 1 13 1595 1 1 5 ARG HD3 H 3.156 7.823 -1.181 1.00 . A A . 5 ARG HD3 1 1 13 1596 1 1 5 ARG HE H 5.231 6.298 -2.381 1.00 . A A . 5 ARG HE 1 1 13 1597 1 1 5 ARG HG2 H 1.701 6.198 -0.393 1.00 . A A . 5 ARG HG2 1 1 13 1598 1 1 5 ARG HG3 H 3.262 5.666 0.236 1.00 . A A . 5 ARG HG3 1 1 13 1599 1 1 5 ARG HH11 H 4.117 7.522 0.692 1.00 . A A . 5 ARG HH11 1 1 13 1600 1 1 5 ARG HH12 H 5.701 7.564 1.390 1.00 . A A . 5 ARG HH12 1 1 13 1601 1 1 5 ARG HH21 H 7.315 6.352 -1.464 1.00 . A A . 5 ARG HH21 1 1 13 1602 1 1 5 ARG HH22 H 7.517 6.900 0.167 1.00 . A A . 5 ARG HH22 1 1 13 1603 1 1 5 ARG N N 0.829 2.857 -2.118 1.00 . A A . 5 ARG N 1 1 13 1604 1 1 5 ARG NE N 4.826 6.640 -1.557 1.00 . A A . 5 ARG NE 1 1 13 1605 1 1 5 ARG NH1 N 5.102 7.368 0.614 1.00 . A A . 5 ARG NH1 1 1 13 1606 1 1 5 ARG NH2 N 6.923 6.702 -0.613 1.00 . A A . 5 ARG NH2 1 1 13 1607 1 1 5 ARG O O 1.480 4.516 -4.320 1.00 . A A . 5 ARG O 1 1 13 1608 1 1 6 HIS C C 0.122 8.460 -4.156 1.00 . A A . 6 HIS C 1 1 13 1609 1 1 6 HIS CA C 0.212 6.974 -4.489 1.00 . A A . 6 HIS CA 1 1 13 1610 1 1 6 HIS CB C -1.042 6.531 -5.244 1.00 . A A . 6 HIS CB 1 1 13 1611 1 1 6 HIS CD2 C -2.549 7.321 -3.286 1.00 . A A . 6 HIS CD2 1 1 13 1612 1 1 6 HIS CE1 C -4.418 6.361 -3.913 1.00 . A A . 6 HIS CE1 1 1 13 1613 1 1 6 HIS CG C -2.299 6.662 -4.442 1.00 . A A . 6 HIS CG 1 1 13 1614 1 1 6 HIS H H 0.023 6.517 -2.431 1.00 . A A . 6 HIS H 1 1 13 1615 1 1 6 HIS HA H 1.076 6.810 -5.115 1.00 . A A . 6 HIS HA 1 1 13 1616 1 1 6 HIS HB2 H -1.151 7.139 -6.134 1.00 . A A . 6 HIS HB2 1 1 13 1617 1 1 6 HIS HB3 H -0.934 5.491 -5.529 1.00 . A A . 6 HIS HB3 1 1 13 1618 1 1 6 HIS HD1 H -3.635 5.521 -5.606 1.00 . A A . 6 HIS HD1 1 1 13 1619 1 1 6 HIS HD2 H -1.838 7.899 -2.711 1.00 . A A . 6 HIS HD2 1 1 13 1620 1 1 6 HIS HE1 H -5.446 6.034 -3.939 1.00 . A A . 6 HIS HE1 1 1 13 1621 1 1 6 HIS HE2 H -4.314 7.402 -2.152 1.00 . A A . 6 HIS HE2 1 1 13 1622 1 1 6 HIS N N 0.380 6.179 -3.278 1.00 . A A . 6 HIS N 1 1 13 1623 1 1 6 HIS ND1 N -3.491 6.071 -4.808 1.00 . A A . 6 HIS ND1 1 1 13 1624 1 1 6 HIS NE2 N -3.872 7.118 -2.979 1.00 . A A . 6 HIS NE2 1 1 13 1625 1 1 6 HIS O O 0.205 8.803 -2.958 1.00 . A A . 6 HIS O 1 1 14 1626 1 1 1 HIS C C 0.124 -6.381 2.651 1.00 . A A . 1 HIS C 1 1 14 1627 1 1 1 HIS CA C -0.062 -7.863 2.340 1.00 . A A . 1 HIS CA 1 1 14 1628 1 1 1 HIS CB C -1.487 -8.123 1.848 1.00 . A A . 1 HIS CB 1 1 14 1629 1 1 1 HIS CD2 C -3.263 -8.710 3.645 1.00 . A A . 1 HIS CD2 1 1 14 1630 1 1 1 HIS CE1 C -3.875 -6.671 4.168 1.00 . A A . 1 HIS CE1 1 1 14 1631 1 1 1 HIS CG C -2.536 -7.859 2.883 1.00 . A A . 1 HIS CG 1 1 14 1632 1 1 1 HIS H1 H 1.192 -8.625 3.782 1.00 . A A . 1 HIS H1 1 1 14 1633 1 1 1 HIS H2 H -0.078 -9.678 3.309 1.00 . A A . 1 HIS H2 1 1 14 1634 1 1 1 HIS H3 H -0.410 -8.327 4.314 1.00 . A A . 1 HIS H3 1 1 14 1635 1 1 1 HIS HA H 0.639 -8.153 1.572 1.00 . A A . 1 HIS HA 1 1 14 1636 1 1 1 HIS HB2 H -1.689 -7.486 1.000 1.00 . A A . 1 HIS HB2 1 1 14 1637 1 1 1 HIS HB3 H -1.571 -9.157 1.544 1.00 . A A . 1 HIS HB3 1 1 14 1638 1 1 1 HIS HD1 H -2.601 -5.753 2.856 1.00 . A A . 1 HIS HD1 1 1 14 1639 1 1 1 HIS HD2 H -3.206 -9.789 3.634 1.00 . A A . 1 HIS HD2 1 1 14 1640 1 1 1 HIS HE1 H -4.378 -5.836 4.633 1.00 . A A . 1 HIS HE1 1 1 14 1641 1 1 1 HIS HE2 H -4.790 -8.291 5.024 1.00 . A A . 1 HIS HE2 1 1 14 1642 1 1 1 HIS N N 0.182 -8.698 3.545 1.00 . A A . 1 HIS N 1 1 14 1643 1 1 1 HIS ND1 N -2.944 -6.589 3.234 1.00 . A A . 1 HIS ND1 1 1 14 1644 1 1 1 HIS NE2 N -4.087 -7.946 4.434 1.00 . A A . 1 HIS NE2 1 1 14 1645 1 1 1 HIS O O -0.011 -5.955 3.798 1.00 . A A . 1 HIS O 1 1 14 1646 1 1 2 ARG C C -0.555 -3.383 1.248 1.00 . A A . 2 ARG C 1 1 14 1647 1 1 2 ARG CA C 0.639 -4.166 1.785 1.00 . A A . 2 ARG CA 1 1 14 1648 1 1 2 ARG CB C 1.920 -3.727 1.071 1.00 . A A . 2 ARG CB 1 1 14 1649 1 1 2 ARG CD C 3.769 -2.025 1.132 1.00 . A A . 2 ARG CD 1 1 14 1650 1 1 2 ARG CG C 2.864 -2.927 1.955 1.00 . A A . 2 ARG CG 1 1 14 1651 1 1 2 ARG CZ C 4.914 0.135 1.441 1.00 . A A . 2 ARG CZ 1 1 14 1652 1 1 2 ARG H H 0.529 -5.998 0.730 1.00 . A A . 2 ARG H 1 1 14 1653 1 1 2 ARG HA H 0.739 -3.965 2.841 1.00 . A A . 2 ARG HA 1 1 14 1654 1 1 2 ARG HB2 H 2.445 -4.606 0.725 1.00 . A A . 2 ARG HB2 1 1 14 1655 1 1 2 ARG HB3 H 1.656 -3.118 0.219 1.00 . A A . 2 ARG HB3 1 1 14 1656 1 1 2 ARG HD2 H 4.740 -2.490 1.048 1.00 . A A . 2 ARG HD2 1 1 14 1657 1 1 2 ARG HD3 H 3.341 -1.908 0.147 1.00 . A A . 2 ARG HD3 1 1 14 1658 1 1 2 ARG HE H 3.264 -0.434 2.408 1.00 . A A . 2 ARG HE 1 1 14 1659 1 1 2 ARG HG2 H 2.281 -2.317 2.628 1.00 . A A . 2 ARG HG2 1 1 14 1660 1 1 2 ARG HG3 H 3.475 -3.612 2.525 1.00 . A A . 2 ARG HG3 1 1 14 1661 1 1 2 ARG HH11 H 5.785 -1.088 0.085 1.00 . A A . 2 ARG HH11 1 1 14 1662 1 1 2 ARG HH12 H 6.570 0.438 0.321 1.00 . A A . 2 ARG HH12 1 1 14 1663 1 1 2 ARG HH21 H 4.295 1.573 2.719 1.00 . A A . 2 ARG HH21 1 1 14 1664 1 1 2 ARG HH22 H 5.725 1.948 1.817 1.00 . A A . 2 ARG HH22 1 1 14 1665 1 1 2 ARG N N 0.435 -5.600 1.621 1.00 . A A . 2 ARG N 1 1 14 1666 1 1 2 ARG NE N 3.928 -0.706 1.740 1.00 . A A . 2 ARG NE 1 1 14 1667 1 1 2 ARG NH1 N 5.832 -0.199 0.542 1.00 . A A . 2 ARG NH1 1 1 14 1668 1 1 2 ARG NH2 N 4.984 1.315 2.042 1.00 . A A . 2 ARG NH2 1 1 14 1669 1 1 2 ARG O O -1.437 -3.944 0.599 1.00 . A A . 2 ARG O 1 1 14 1670 1 1 3 PHE C C -1.272 -0.465 -0.192 1.00 . A A . 3 PHE C 1 1 14 1671 1 1 3 PHE CA C -1.662 -1.224 1.071 1.00 . A A . 3 PHE CA 1 1 14 1672 1 1 3 PHE CB C -2.062 -0.243 2.171 1.00 . A A . 3 PHE CB 1 1 14 1673 1 1 3 PHE CD1 C -4.343 -1.305 2.309 1.00 . A A . 3 PHE CD1 1 1 14 1674 1 1 3 PHE CD2 C -4.143 1.027 2.771 1.00 . A A . 3 PHE CD2 1 1 14 1675 1 1 3 PHE CE1 C -5.704 -1.237 2.541 1.00 . A A . 3 PHE CE1 1 1 14 1676 1 1 3 PHE CE2 C -5.503 1.100 3.004 1.00 . A A . 3 PHE CE2 1 1 14 1677 1 1 3 PHE CG C -3.546 -0.174 2.421 1.00 . A A . 3 PHE CG 1 1 14 1678 1 1 3 PHE CZ C -6.284 -0.033 2.889 1.00 . A A . 3 PHE CZ 1 1 14 1679 1 1 3 PHE H H 0.156 -1.693 2.047 1.00 . A A . 3 PHE H 1 1 14 1680 1 1 3 PHE HA H -2.503 -1.849 0.843 1.00 . A A . 3 PHE HA 1 1 14 1681 1 1 3 PHE HB2 H -1.583 -0.536 3.098 1.00 . A A . 3 PHE HB2 1 1 14 1682 1 1 3 PHE HB3 H -1.729 0.743 1.889 1.00 . A A . 3 PHE HB3 1 1 14 1683 1 1 3 PHE HD1 H -3.892 -2.247 2.036 1.00 . A A . 3 PHE HD1 1 1 14 1684 1 1 3 PHE HD2 H -3.533 1.914 2.862 1.00 . A A . 3 PHE HD2 1 1 14 1685 1 1 3 PHE HE1 H -6.313 -2.124 2.450 1.00 . A A . 3 PHE HE1 1 1 14 1686 1 1 3 PHE HE2 H -5.954 2.043 3.276 1.00 . A A . 3 PHE HE2 1 1 14 1687 1 1 3 PHE HZ H -7.347 0.023 3.071 1.00 . A A . 3 PHE HZ 1 1 14 1688 1 1 3 PHE N N -0.576 -2.083 1.525 1.00 . A A . 3 PHE N 1 1 14 1689 1 1 3 PHE O O -0.112 -0.478 -0.605 1.00 . A A . 3 PHE O 1 1 14 1690 1 1 4 LEU C C -1.741 2.415 -1.716 1.00 . A A . 4 LEU C 1 1 14 1691 1 1 4 LEU CA C -2.020 0.948 -2.025 1.00 . A A . 4 LEU CA 1 1 14 1692 1 1 4 LEU CB C -3.221 0.829 -2.963 1.00 . A A . 4 LEU CB 1 1 14 1693 1 1 4 LEU CD1 C -4.879 -0.677 -1.858 1.00 . A A . 4 LEU CD1 1 1 14 1694 1 1 4 LEU CD2 C -4.539 -0.805 -4.334 1.00 . A A . 4 LEU CD2 1 1 14 1695 1 1 4 LEU CG C -3.875 -0.551 -2.988 1.00 . A A . 4 LEU CG 1 1 14 1696 1 1 4 LEU H H -3.155 0.156 -0.426 1.00 . A A . 4 LEU H 1 1 14 1697 1 1 4 LEU HA H -1.161 0.523 -2.510 1.00 . A A . 4 LEU HA 1 1 14 1698 1 1 4 LEU HB2 H -3.963 1.554 -2.659 1.00 . A A . 4 LEU HB2 1 1 14 1699 1 1 4 LEU HB3 H -2.896 1.068 -3.964 1.00 . A A . 4 LEU HB3 1 1 14 1700 1 1 4 LEU HD11 H -4.913 0.250 -1.306 1.00 . A A . 4 LEU HD11 1 1 14 1701 1 1 4 LEU HD12 H -4.574 -1.475 -1.199 1.00 . A A . 4 LEU HD12 1 1 14 1702 1 1 4 LEU HD13 H -5.856 -0.894 -2.261 1.00 . A A . 4 LEU HD13 1 1 14 1703 1 1 4 LEU HD21 H -4.654 -1.869 -4.483 1.00 . A A . 4 LEU HD21 1 1 14 1704 1 1 4 LEU HD22 H -3.923 -0.396 -5.122 1.00 . A A . 4 LEU HD22 1 1 14 1705 1 1 4 LEU HD23 H -5.509 -0.332 -4.353 1.00 . A A . 4 LEU HD23 1 1 14 1706 1 1 4 LEU HG H -3.115 -1.304 -2.838 1.00 . A A . 4 LEU HG 1 1 14 1707 1 1 4 LEU N N -2.253 0.189 -0.804 1.00 . A A . 4 LEU N 1 1 14 1708 1 1 4 LEU O O -2.633 3.153 -1.297 1.00 . A A . 4 LEU O 1 1 14 1709 1 1 5 ARG C C 1.062 4.618 -2.572 1.00 . A A . 5 ARG C 1 1 14 1710 1 1 5 ARG CA C -0.098 4.211 -1.669 1.00 . A A . 5 ARG CA 1 1 14 1711 1 1 5 ARG CB C 0.296 4.386 -0.202 1.00 . A A . 5 ARG CB 1 1 14 1712 1 1 5 ARG CD C 1.386 6.592 0.311 1.00 . A A . 5 ARG CD 1 1 14 1713 1 1 5 ARG CG C 0.089 5.800 0.317 1.00 . A A . 5 ARG CG 1 1 14 1714 1 1 5 ARG CZ C 1.996 6.824 2.687 1.00 . A A . 5 ARG CZ 1 1 14 1715 1 1 5 ARG H H 0.171 2.196 -2.260 1.00 . A A . 5 ARG H 1 1 14 1716 1 1 5 ARG HA H -0.945 4.845 -1.883 1.00 . A A . 5 ARG HA 1 1 14 1717 1 1 5 ARG HB2 H -0.301 3.713 0.403 1.00 . A A . 5 ARG HB2 1 1 14 1718 1 1 5 ARG HB3 H 1.344 4.134 -0.090 1.00 . A A . 5 ARG HB3 1 1 14 1719 1 1 5 ARG HD2 H 1.942 6.341 -0.580 1.00 . A A . 5 ARG HD2 1 1 14 1720 1 1 5 ARG HD3 H 1.149 7.646 0.301 1.00 . A A . 5 ARG HD3 1 1 14 1721 1 1 5 ARG HE H 2.964 5.687 1.363 1.00 . A A . 5 ARG HE 1 1 14 1722 1 1 5 ARG HG2 H -0.631 6.302 -0.312 1.00 . A A . 5 ARG HG2 1 1 14 1723 1 1 5 ARG HG3 H -0.288 5.750 1.328 1.00 . A A . 5 ARG HG3 1 1 14 1724 1 1 5 ARG HH11 H 0.382 7.906 2.127 1.00 . A A . 5 ARG HH11 1 1 14 1725 1 1 5 ARG HH12 H 0.831 8.050 3.793 1.00 . A A . 5 ARG HH12 1 1 14 1726 1 1 5 ARG HH21 H 3.556 5.875 3.554 1.00 . A A . 5 ARG HH21 1 1 14 1727 1 1 5 ARG HH22 H 2.633 6.898 4.604 1.00 . A A . 5 ARG HH22 1 1 14 1728 1 1 5 ARG N N -0.496 2.831 -1.925 1.00 . A A . 5 ARG N 1 1 14 1729 1 1 5 ARG NE N 2.211 6.302 1.481 1.00 . A A . 5 ARG NE 1 1 14 1730 1 1 5 ARG NH1 N 0.987 7.662 2.885 1.00 . A A . 5 ARG NH1 1 1 14 1731 1 1 5 ARG NH2 N 2.794 6.506 3.698 1.00 . A A . 5 ARG NH2 1 1 14 1732 1 1 5 ARG O O 2.010 3.857 -2.762 1.00 . A A . 5 ARG O 1 1 14 1733 1 1 6 HIS C C 2.021 7.857 -4.030 1.00 . A A . 6 HIS C 1 1 14 1734 1 1 6 HIS CA C 2.023 6.332 -4.007 1.00 . A A . 6 HIS CA 1 1 14 1735 1 1 6 HIS CB C 1.831 5.789 -5.424 1.00 . A A . 6 HIS CB 1 1 14 1736 1 1 6 HIS CD2 C -0.727 5.796 -5.852 1.00 . A A . 6 HIS CD2 1 1 14 1737 1 1 6 HIS CE1 C -0.790 7.349 -7.398 1.00 . A A . 6 HIS CE1 1 1 14 1738 1 1 6 HIS CG C 0.544 6.216 -6.058 1.00 . A A . 6 HIS CG 1 1 14 1739 1 1 6 HIS H H 0.199 6.385 -2.935 1.00 . A A . 6 HIS H 1 1 14 1740 1 1 6 HIS HA H 2.974 5.991 -3.627 1.00 . A A . 6 HIS HA 1 1 14 1741 1 1 6 HIS HB2 H 2.642 6.141 -6.051 1.00 . A A . 6 HIS HB2 1 1 14 1742 1 1 6 HIS HB3 H 1.844 4.705 -5.392 1.00 . A A . 6 HIS HB3 1 1 14 1743 1 1 6 HIS HD1 H 1.228 7.688 -7.402 1.00 . A A . 6 HIS HD1 1 1 14 1744 1 1 6 HIS HD2 H -1.046 5.036 -5.153 1.00 . A A . 6 HIS HD2 1 1 14 1745 1 1 6 HIS HE1 H -1.148 8.043 -8.144 1.00 . A A . 6 HIS HE1 1 1 14 1746 1 1 6 HIS HE2 H -2.495 6.368 -6.830 1.00 . A A . 6 HIS HE2 1 1 14 1747 1 1 6 HIS N N 0.980 5.824 -3.125 1.00 . A A . 6 HIS N 1 1 14 1748 1 1 6 HIS ND1 N 0.470 7.189 -7.033 1.00 . A A . 6 HIS ND1 1 1 14 1749 1 1 6 HIS NE2 N -1.536 6.516 -6.697 1.00 . A A . 6 HIS NE2 1 1 14 1750 1 1 6 HIS O O 2.821 8.438 -4.794 1.00 . A A . 6 HIS O 1 1 15 1751 1 1 1 HIS C C 0.212 -6.566 2.865 1.00 . A A . 1 HIS C 1 1 15 1752 1 1 1 HIS CA C -0.117 -8.004 2.478 1.00 . A A . 1 HIS CA 1 1 15 1753 1 1 1 HIS CB C -0.983 -8.657 3.557 1.00 . A A . 1 HIS CB 1 1 15 1754 1 1 1 HIS CD2 C -1.519 -10.666 2.006 1.00 . A A . 1 HIS CD2 1 1 15 1755 1 1 1 HIS CE1 C -3.276 -11.432 3.071 1.00 . A A . 1 HIS CE1 1 1 15 1756 1 1 1 HIS CG C -1.728 -9.864 3.077 1.00 . A A . 1 HIS CG 1 1 15 1757 1 1 1 HIS H1 H 0.846 -9.815 2.303 1.00 . A A . 1 HIS H1 1 1 15 1758 1 1 1 HIS H2 H 1.747 -8.600 3.115 1.00 . A A . 1 HIS H2 1 1 15 1759 1 1 1 HIS H3 H 1.559 -8.538 1.410 1.00 . A A . 1 HIS H3 1 1 15 1760 1 1 1 HIS HA H -0.655 -8.003 1.542 1.00 . A A . 1 HIS HA 1 1 15 1761 1 1 1 HIS HB2 H -0.353 -8.961 4.379 1.00 . A A . 1 HIS HB2 1 1 15 1762 1 1 1 HIS HB3 H -1.707 -7.937 3.911 1.00 . A A . 1 HIS HB3 1 1 15 1763 1 1 1 HIS HD1 H -3.240 -10.006 4.538 1.00 . A A . 1 HIS HD1 1 1 15 1764 1 1 1 HIS HD2 H -0.732 -10.565 1.273 1.00 . A A . 1 HIS HD2 1 1 15 1765 1 1 1 HIS HE1 H -4.130 -12.034 3.347 1.00 . A A . 1 HIS HE1 1 1 15 1766 1 1 1 HIS HE2 H -2.545 -12.403 1.423 1.00 . A A . 1 HIS HE2 1 1 15 1767 1 1 1 HIS N N 1.120 -8.812 2.312 1.00 . A A . 1 HIS N 1 1 15 1768 1 1 1 HIS ND1 N -2.836 -10.370 3.723 1.00 . A A . 1 HIS ND1 1 1 15 1769 1 1 1 HIS NE2 N -2.495 -11.632 2.026 1.00 . A A . 1 HIS NE2 1 1 15 1770 1 1 1 HIS O O 0.779 -6.313 3.928 1.00 . A A . 1 HIS O 1 1 15 1771 1 1 2 ARG C C -0.942 -3.342 1.565 1.00 . A A . 2 ARG C 1 1 15 1772 1 1 2 ARG CA C 0.108 -4.215 2.246 1.00 . A A . 2 ARG CA 1 1 15 1773 1 1 2 ARG CB C 1.504 -3.833 1.751 1.00 . A A . 2 ARG CB 1 1 15 1774 1 1 2 ARG CD C 3.333 -3.422 3.428 1.00 . A A . 2 ARG CD 1 1 15 1775 1 1 2 ARG CG C 2.199 -2.802 2.627 1.00 . A A . 2 ARG CG 1 1 15 1776 1 1 2 ARG CZ C 3.715 -1.772 5.217 1.00 . A A . 2 ARG CZ 1 1 15 1777 1 1 2 ARG H H -0.597 -5.892 1.165 1.00 . A A . 2 ARG H 1 1 15 1778 1 1 2 ARG HA H 0.057 -4.052 3.312 1.00 . A A . 2 ARG HA 1 1 15 1779 1 1 2 ARG HB2 H 2.118 -4.721 1.719 1.00 . A A . 2 ARG HB2 1 1 15 1780 1 1 2 ARG HB3 H 1.421 -3.428 0.753 1.00 . A A . 2 ARG HB3 1 1 15 1781 1 1 2 ARG HD2 H 2.914 -4.102 4.154 1.00 . A A . 2 ARG HD2 1 1 15 1782 1 1 2 ARG HD3 H 3.976 -3.969 2.753 1.00 . A A . 2 ARG HD3 1 1 15 1783 1 1 2 ARG HE H 5.012 -2.202 3.762 1.00 . A A . 2 ARG HE 1 1 15 1784 1 1 2 ARG HG2 H 2.602 -2.022 1.998 1.00 . A A . 2 ARG HG2 1 1 15 1785 1 1 2 ARG HG3 H 1.477 -2.379 3.310 1.00 . A A . 2 ARG HG3 1 1 15 1786 1 1 2 ARG HH11 H 1.926 -2.711 5.311 1.00 . A A . 2 ARG HH11 1 1 15 1787 1 1 2 ARG HH12 H 2.219 -1.545 6.558 1.00 . A A . 2 ARG HH12 1 1 15 1788 1 1 2 ARG HH21 H 5.399 -0.670 5.402 1.00 . A A . 2 ARG HH21 1 1 15 1789 1 1 2 ARG HH22 H 4.190 -0.386 6.609 1.00 . A A . 2 ARG HH22 1 1 15 1790 1 1 2 ARG N N -0.148 -5.628 1.995 1.00 . A A . 2 ARG N 1 1 15 1791 1 1 2 ARG NE N 4.126 -2.413 4.126 1.00 . A A . 2 ARG NE 1 1 15 1792 1 1 2 ARG NH1 N 2.522 -2.031 5.738 1.00 . A A . 2 ARG NH1 1 1 15 1793 1 1 2 ARG NH2 N 4.499 -0.869 5.790 1.00 . A A . 2 ARG NH2 1 1 15 1794 1 1 2 ARG O O -1.790 -3.839 0.824 1.00 . A A . 2 ARG O 1 1 15 1795 1 1 3 PHE C C -1.260 -0.483 -0.042 1.00 . A A . 3 PHE C 1 1 15 1796 1 1 3 PHE CA C -1.823 -1.098 1.233 1.00 . A A . 3 PHE CA 1 1 15 1797 1 1 3 PHE CB C -2.176 -0.001 2.235 1.00 . A A . 3 PHE CB 1 1 15 1798 1 1 3 PHE CD1 C -4.561 -0.807 2.316 1.00 . A A . 3 PHE CD1 1 1 15 1799 1 1 3 PHE CD2 C -4.137 1.525 2.586 1.00 . A A . 3 PHE CD2 1 1 15 1800 1 1 3 PHE CE1 C -5.917 -0.579 2.452 1.00 . A A . 3 PHE CE1 1 1 15 1801 1 1 3 PHE CE2 C -5.493 1.758 2.723 1.00 . A A . 3 PHE CE2 1 1 15 1802 1 1 3 PHE CG C -3.655 0.242 2.381 1.00 . A A . 3 PHE CG 1 1 15 1803 1 1 3 PHE CZ C -6.384 0.705 2.656 1.00 . A A . 3 PHE CZ 1 1 15 1804 1 1 3 PHE H H -0.179 -1.704 2.420 1.00 . A A . 3 PHE H 1 1 15 1805 1 1 3 PHE HA H -2.715 -1.639 0.984 1.00 . A A . 3 PHE HA 1 1 15 1806 1 1 3 PHE HB2 H -1.787 -0.272 3.209 1.00 . A A . 3 PHE HB2 1 1 15 1807 1 1 3 PHE HB3 H -1.720 0.921 1.909 1.00 . A A . 3 PHE HB3 1 1 15 1808 1 1 3 PHE HD1 H -4.199 -1.811 2.155 1.00 . A A . 3 PHE HD1 1 1 15 1809 1 1 3 PHE HD2 H -3.442 2.350 2.639 1.00 . A A . 3 PHE HD2 1 1 15 1810 1 1 3 PHE HE1 H -6.612 -1.404 2.399 1.00 . A A . 3 PHE HE1 1 1 15 1811 1 1 3 PHE HE2 H -5.855 2.763 2.882 1.00 . A A . 3 PHE HE2 1 1 15 1812 1 1 3 PHE HZ H -7.443 0.885 2.762 1.00 . A A . 3 PHE HZ 1 1 15 1813 1 1 3 PHE N N -0.878 -2.040 1.822 1.00 . A A . 3 PHE N 1 1 15 1814 1 1 3 PHE O O -0.084 -0.656 -0.362 1.00 . A A . 3 PHE O 1 1 15 1815 1 1 4 LEU C C -1.449 2.359 -1.811 1.00 . A A . 4 LEU C 1 1 15 1816 1 1 4 LEU CA C -1.704 0.870 -2.015 1.00 . A A . 4 LEU CA 1 1 15 1817 1 1 4 LEU CB C -2.765 0.662 -3.096 1.00 . A A . 4 LEU CB 1 1 15 1818 1 1 4 LEU CD1 C -4.644 -0.562 -1.999 1.00 . A A . 4 LEU CD1 1 1 15 1819 1 1 4 LEU CD2 C -4.044 -1.075 -4.374 1.00 . A A . 4 LEU CD2 1 1 15 1820 1 1 4 LEU CG C -3.516 -0.665 -3.007 1.00 . A A . 4 LEU CG 1 1 15 1821 1 1 4 LEU H H -3.034 0.329 -0.463 1.00 . A A . 4 LEU H 1 1 15 1822 1 1 4 LEU HA H -0.792 0.400 -2.333 1.00 . A A . 4 LEU HA 1 1 15 1823 1 1 4 LEU HB2 H -3.483 1.466 -3.026 1.00 . A A . 4 LEU HB2 1 1 15 1824 1 1 4 LEU HB3 H -2.283 0.714 -4.060 1.00 . A A . 4 LEU HB3 1 1 15 1825 1 1 4 LEU HD11 H -4.494 -1.293 -1.220 1.00 . A A . 4 LEU HD11 1 1 15 1826 1 1 4 LEU HD12 H -5.588 -0.744 -2.490 1.00 . A A . 4 LEU HD12 1 1 15 1827 1 1 4 LEU HD13 H -4.645 0.428 -1.567 1.00 . A A . 4 LEU HD13 1 1 15 1828 1 1 4 LEU HD21 H -4.950 -1.650 -4.252 1.00 . A A . 4 LEU HD21 1 1 15 1829 1 1 4 LEU HD22 H -3.302 -1.675 -4.882 1.00 . A A . 4 LEU HD22 1 1 15 1830 1 1 4 LEU HD23 H -4.254 -0.192 -4.959 1.00 . A A . 4 LEU HD23 1 1 15 1831 1 1 4 LEU HG H -2.836 -1.431 -2.663 1.00 . A A . 4 LEU HG 1 1 15 1832 1 1 4 LEU N N -2.111 0.232 -0.770 1.00 . A A . 4 LEU N 1 1 15 1833 1 1 4 LEU O O -2.374 3.127 -1.546 1.00 . A A . 4 LEU O 1 1 15 1834 1 1 5 ARG C C 0.991 4.657 -2.965 1.00 . A A . 5 ARG C 1 1 15 1835 1 1 5 ARG CA C 0.188 4.160 -1.767 1.00 . A A . 5 ARG CA 1 1 15 1836 1 1 5 ARG CB C 1.002 4.338 -0.484 1.00 . A A . 5 ARG CB 1 1 15 1837 1 1 5 ARG CD C 1.845 6.683 -0.156 1.00 . A A . 5 ARG CD 1 1 15 1838 1 1 5 ARG CG C 0.766 5.674 0.201 1.00 . A A . 5 ARG CG 1 1 15 1839 1 1 5 ARG CZ C 0.945 8.856 0.577 1.00 . A A . 5 ARG CZ 1 1 15 1840 1 1 5 ARG H H 0.504 2.102 -2.150 1.00 . A A . 5 ARG H 1 1 15 1841 1 1 5 ARG HA H -0.718 4.741 -1.691 1.00 . A A . 5 ARG HA 1 1 15 1842 1 1 5 ARG HB2 H 0.736 3.549 0.210 1.00 . A A . 5 ARG HB2 1 1 15 1843 1 1 5 ARG HB3 H 2.056 4.262 -0.726 1.00 . A A . 5 ARG HB3 1 1 15 1844 1 1 5 ARG HD2 H 2.553 6.737 0.658 1.00 . A A . 5 ARG HD2 1 1 15 1845 1 1 5 ARG HD3 H 2.351 6.348 -1.050 1.00 . A A . 5 ARG HD3 1 1 15 1846 1 1 5 ARG HE H 1.176 8.296 -1.325 1.00 . A A . 5 ARG HE 1 1 15 1847 1 1 5 ARG HG2 H -0.192 6.063 -0.110 1.00 . A A . 5 ARG HG2 1 1 15 1848 1 1 5 ARG HG3 H 0.765 5.523 1.270 1.00 . A A . 5 ARG HG3 1 1 15 1849 1 1 5 ARG HH11 H 1.462 7.612 2.086 1.00 . A A . 5 ARG HH11 1 1 15 1850 1 1 5 ARG HH12 H 0.826 9.147 2.574 1.00 . A A . 5 ARG HH12 1 1 15 1851 1 1 5 ARG HH21 H 0.340 10.315 -0.684 1.00 . A A . 5 ARG HH21 1 1 15 1852 1 1 5 ARG HH22 H 0.189 10.682 1.002 1.00 . A A . 5 ARG HH22 1 1 15 1853 1 1 5 ARG N N -0.189 2.762 -1.937 1.00 . A A . 5 ARG N 1 1 15 1854 1 1 5 ARG NE N 1.294 8.014 -0.393 1.00 . A A . 5 ARG NE 1 1 15 1855 1 1 5 ARG NH1 N 1.090 8.510 1.850 1.00 . A A . 5 ARG NH1 1 1 15 1856 1 1 5 ARG NH2 N 0.451 10.049 0.273 1.00 . A A . 5 ARG NH2 1 1 15 1857 1 1 5 ARG O O 1.640 3.874 -3.659 1.00 . A A . 5 ARG O 1 1 15 1858 1 1 6 HIS C C 2.121 7.980 -3.969 1.00 . A A . 6 HIS C 1 1 15 1859 1 1 6 HIS CA C 1.667 6.566 -4.316 1.00 . A A . 6 HIS CA 1 1 15 1860 1 1 6 HIS CB C 0.787 6.593 -5.567 1.00 . A A . 6 HIS CB 1 1 15 1861 1 1 6 HIS CD2 C -1.578 6.990 -4.579 1.00 . A A . 6 HIS CD2 1 1 15 1862 1 1 6 HIS CE1 C -2.058 8.850 -5.636 1.00 . A A . 6 HIS CE1 1 1 15 1863 1 1 6 HIS CG C -0.518 7.297 -5.364 1.00 . A A . 6 HIS CG 1 1 15 1864 1 1 6 HIS H H 0.409 6.537 -2.614 1.00 . A A . 6 HIS H 1 1 15 1865 1 1 6 HIS HA H 2.538 5.959 -4.512 1.00 . A A . 6 HIS HA 1 1 15 1866 1 1 6 HIS HB2 H 1.319 7.103 -6.362 1.00 . A A . 6 HIS HB2 1 1 15 1867 1 1 6 HIS HB3 H 0.574 5.574 -5.871 1.00 . A A . 6 HIS HB3 1 1 15 1868 1 1 6 HIS HD1 H -0.287 8.947 -6.655 1.00 . A A . 6 HIS HD1 1 1 15 1869 1 1 6 HIS HD2 H -1.666 6.133 -3.927 1.00 . A A . 6 HIS HD2 1 1 15 1870 1 1 6 HIS HE1 H -2.579 9.732 -5.980 1.00 . A A . 6 HIS HE1 1 1 15 1871 1 1 6 HIS HE2 H -3.358 8.059 -4.264 1.00 . A A . 6 HIS HE2 1 1 15 1872 1 1 6 HIS N N 0.943 5.964 -3.202 1.00 . A A . 6 HIS N 1 1 15 1873 1 1 6 HIS ND1 N -0.852 8.468 -6.013 1.00 . A A . 6 HIS ND1 1 1 15 1874 1 1 6 HIS NE2 N -2.521 7.971 -4.767 1.00 . A A . 6 HIS NE2 1 1 15 1875 1 1 6 HIS O O 1.259 8.884 -3.925 1.00 . A A . 6 HIS O 1 1 16 1876 1 1 1 HIS C C 0.026 -6.565 3.052 1.00 . A A . 1 HIS C 1 1 16 1877 1 1 1 HIS CA C -0.329 -8.022 2.774 1.00 . A A . 1 HIS CA 1 1 16 1878 1 1 1 HIS CB C -1.125 -8.604 3.944 1.00 . A A . 1 HIS CB 1 1 16 1879 1 1 1 HIS CD2 C -2.378 -10.816 4.454 1.00 . A A . 1 HIS CD2 1 1 16 1880 1 1 1 HIS CE1 C -2.302 -11.697 2.448 1.00 . A A . 1 HIS CE1 1 1 16 1881 1 1 1 HIS CG C -1.727 -9.942 3.651 1.00 . A A . 1 HIS CG 1 1 16 1882 1 1 1 HIS H1 H 1.528 -8.323 1.941 1.00 . A A . 1 HIS H1 1 1 16 1883 1 1 1 HIS H2 H 0.601 -9.751 2.159 1.00 . A A . 1 HIS H2 1 1 16 1884 1 1 1 HIS H3 H 1.333 -8.986 3.509 1.00 . A A . 1 HIS H3 1 1 16 1885 1 1 1 HIS HA H -0.927 -8.074 1.877 1.00 . A A . 1 HIS HA 1 1 16 1886 1 1 1 HIS HB2 H -0.471 -8.714 4.796 1.00 . A A . 1 HIS HB2 1 1 16 1887 1 1 1 HIS HB3 H -1.927 -7.925 4.197 1.00 . A A . 1 HIS HB3 1 1 16 1888 1 1 1 HIS HD1 H -1.290 -10.135 1.598 1.00 . A A . 1 HIS HD1 1 1 16 1889 1 1 1 HIS HD2 H -2.587 -10.687 5.507 1.00 . A A . 1 HIS HD2 1 1 16 1890 1 1 1 HIS HE1 H -2.430 -12.376 1.618 1.00 . A A . 1 HIS HE1 1 1 16 1891 1 1 1 HIS HE2 H -3.282 -12.650 3.973 1.00 . A A . 1 HIS HE2 1 1 16 1892 1 1 1 HIS N N 0.894 -8.844 2.578 1.00 . A A . 1 HIS N 1 1 16 1893 1 1 1 HIS ND1 N -1.696 -10.524 2.401 1.00 . A A . 1 HIS ND1 1 1 16 1894 1 1 1 HIS NE2 N -2.725 -11.898 3.682 1.00 . A A . 1 HIS NE2 1 1 16 1895 1 1 1 HIS O O 0.459 -6.220 4.151 1.00 . A A . 1 HIS O 1 1 16 1896 1 1 2 ARG C C -0.938 -3.442 1.522 1.00 . A A . 2 ARG C 1 1 16 1897 1 1 2 ARG CA C 0.140 -4.294 2.185 1.00 . A A . 2 ARG CA 1 1 16 1898 1 1 2 ARG CB C 1.507 -3.980 1.574 1.00 . A A . 2 ARG CB 1 1 16 1899 1 1 2 ARG CD C 2.571 -2.473 3.279 1.00 . A A . 2 ARG CD 1 1 16 1900 1 1 2 ARG CG C 2.614 -3.834 2.605 1.00 . A A . 2 ARG CG 1 1 16 1901 1 1 2 ARG CZ C 3.676 -2.868 5.445 1.00 . A A . 2 ARG CZ 1 1 16 1902 1 1 2 ARG H H -0.509 -6.049 1.196 1.00 . A A . 2 ARG H 1 1 16 1903 1 1 2 ARG HA H 0.165 -4.061 3.239 1.00 . A A . 2 ARG HA 1 1 16 1904 1 1 2 ARG HB2 H 1.778 -4.778 0.898 1.00 . A A . 2 ARG HB2 1 1 16 1905 1 1 2 ARG HB3 H 1.439 -3.057 1.018 1.00 . A A . 2 ARG HB3 1 1 16 1906 1 1 2 ARG HD2 H 2.651 -1.707 2.521 1.00 . A A . 2 ARG HD2 1 1 16 1907 1 1 2 ARG HD3 H 1.627 -2.370 3.794 1.00 . A A . 2 ARG HD3 1 1 16 1908 1 1 2 ARG HE H 4.414 -1.739 3.974 1.00 . A A . 2 ARG HE 1 1 16 1909 1 1 2 ARG HG2 H 2.496 -4.600 3.357 1.00 . A A . 2 ARG HG2 1 1 16 1910 1 1 2 ARG HG3 H 3.569 -3.953 2.113 1.00 . A A . 2 ARG HG3 1 1 16 1911 1 1 2 ARG HH11 H 1.893 -3.798 5.231 1.00 . A A . 2 ARG HH11 1 1 16 1912 1 1 2 ARG HH12 H 2.690 -4.060 6.746 1.00 . A A . 2 ARG HH12 1 1 16 1913 1 1 2 ARG HH21 H 5.465 -2.084 5.966 1.00 . A A . 2 ARG HH21 1 1 16 1914 1 1 2 ARG HH22 H 4.717 -3.087 7.163 1.00 . A A . 2 ARG HH22 1 1 16 1915 1 1 2 ARG N N -0.161 -5.714 2.049 1.00 . A A . 2 ARG N 1 1 16 1916 1 1 2 ARG NE N 3.658 -2.303 4.240 1.00 . A A . 2 ARG NE 1 1 16 1917 1 1 2 ARG NH1 N 2.670 -3.638 5.840 1.00 . A A . 2 ARG NH1 1 1 16 1918 1 1 2 ARG NH2 N 4.704 -2.663 6.258 1.00 . A A . 2 ARG NH2 1 1 16 1919 1 1 2 ARG O O -1.875 -3.967 0.920 1.00 . A A . 2 ARG O 1 1 16 1920 1 1 3 PHE C C -1.170 -0.491 -0.160 1.00 . A A . 3 PHE C 1 1 16 1921 1 1 3 PHE CA C -1.760 -1.202 1.051 1.00 . A A . 3 PHE CA 1 1 16 1922 1 1 3 PHE CB C -2.224 -0.182 2.089 1.00 . A A . 3 PHE CB 1 1 16 1923 1 1 3 PHE CD1 C -4.571 -1.084 1.923 1.00 . A A . 3 PHE CD1 1 1 16 1924 1 1 3 PHE CD2 C -4.273 1.219 2.469 1.00 . A A . 3 PHE CD2 1 1 16 1925 1 1 3 PHE CE1 C -5.942 -0.925 1.991 1.00 . A A . 3 PHE CE1 1 1 16 1926 1 1 3 PHE CE2 C -5.643 1.382 2.539 1.00 . A A . 3 PHE CE2 1 1 16 1927 1 1 3 PHE CG C -3.719 -0.014 2.160 1.00 . A A . 3 PHE CG 1 1 16 1928 1 1 3 PHE CZ C -6.479 0.309 2.300 1.00 . A A . 3 PHE CZ 1 1 16 1929 1 1 3 PHE H H -0.030 -1.768 2.131 1.00 . A A . 3 PHE H 1 1 16 1930 1 1 3 PHE HA H -2.607 -1.773 0.726 1.00 . A A . 3 PHE HA 1 1 16 1931 1 1 3 PHE HB2 H -1.878 -0.490 3.068 1.00 . A A . 3 PHE HB2 1 1 16 1932 1 1 3 PHE HB3 H -1.796 0.778 1.842 1.00 . A A . 3 PHE HB3 1 1 16 1933 1 1 3 PHE HD1 H -4.154 -2.050 1.680 1.00 . A A . 3 PHE HD1 1 1 16 1934 1 1 3 PHE HD2 H -3.621 2.059 2.657 1.00 . A A . 3 PHE HD2 1 1 16 1935 1 1 3 PHE HE1 H -6.594 -1.766 1.804 1.00 . A A . 3 PHE HE1 1 1 16 1936 1 1 3 PHE HE2 H -6.060 2.349 2.780 1.00 . A A . 3 PHE HE2 1 1 16 1937 1 1 3 PHE HZ H -7.550 0.435 2.354 1.00 . A A . 3 PHE HZ 1 1 16 1938 1 1 3 PHE N N -0.798 -2.126 1.638 1.00 . A A . 3 PHE N 1 1 16 1939 1 1 3 PHE O O 0.027 -0.589 -0.431 1.00 . A A . 3 PHE O 1 1 16 1940 1 1 4 LEU C C -1.050 2.320 -1.718 1.00 . A A . 4 LEU C 1 1 16 1941 1 1 4 LEU CA C -1.596 0.942 -2.078 1.00 . A A . 4 LEU CA 1 1 16 1942 1 1 4 LEU CB C -2.756 1.076 -3.062 1.00 . A A . 4 LEU CB 1 1 16 1943 1 1 4 LEU CD1 C -4.683 -0.260 -2.194 1.00 . A A . 4 LEU CD1 1 1 16 1944 1 1 4 LEU CD2 C -4.174 -0.254 -4.646 1.00 . A A . 4 LEU CD2 1 1 16 1945 1 1 4 LEU CG C -3.587 -0.193 -3.243 1.00 . A A . 4 LEU CG 1 1 16 1946 1 1 4 LEU H H -2.964 0.254 -0.621 1.00 . A A . 4 LEU H 1 1 16 1947 1 1 4 LEU HA H -0.815 0.367 -2.542 1.00 . A A . 4 LEU HA 1 1 16 1948 1 1 4 LEU HB2 H -3.408 1.865 -2.715 1.00 . A A . 4 LEU HB2 1 1 16 1949 1 1 4 LEU HB3 H -2.356 1.357 -4.024 1.00 . A A . 4 LEU HB3 1 1 16 1950 1 1 4 LEU HD11 H -4.520 -1.120 -1.564 1.00 . A A . 4 LEU HD11 1 1 16 1951 1 1 4 LEU HD12 H -5.644 -0.343 -2.678 1.00 . A A . 4 LEU HD12 1 1 16 1952 1 1 4 LEU HD13 H -4.656 0.636 -1.592 1.00 . A A . 4 LEU HD13 1 1 16 1953 1 1 4 LEU HD21 H -3.561 0.329 -5.317 1.00 . A A . 4 LEU HD21 1 1 16 1954 1 1 4 LEU HD22 H -5.177 0.146 -4.634 1.00 . A A . 4 LEU HD22 1 1 16 1955 1 1 4 LEU HD23 H -4.199 -1.280 -4.981 1.00 . A A . 4 LEU HD23 1 1 16 1956 1 1 4 LEU HG H -2.949 -1.055 -3.106 1.00 . A A . 4 LEU HG 1 1 16 1957 1 1 4 LEU N N -2.023 0.219 -0.888 1.00 . A A . 4 LEU N 1 1 16 1958 1 1 4 LEU O O -1.697 3.090 -1.010 1.00 . A A . 4 LEU O 1 1 16 1959 1 1 5 ARG C C 0.817 4.772 -3.196 1.00 . A A . 5 ARG C 1 1 16 1960 1 1 5 ARG CA C 0.783 3.906 -1.941 1.00 . A A . 5 ARG CA 1 1 16 1961 1 1 5 ARG CB C 2.205 3.693 -1.417 1.00 . A A . 5 ARG CB 1 1 16 1962 1 1 5 ARG CD C 3.514 5.818 -1.130 1.00 . A A . 5 ARG CD 1 1 16 1963 1 1 5 ARG CG C 2.659 4.766 -0.441 1.00 . A A . 5 ARG CG 1 1 16 1964 1 1 5 ARG CZ C 4.033 7.324 0.750 1.00 . A A . 5 ARG CZ 1 1 16 1965 1 1 5 ARG H H 0.614 1.965 -2.768 1.00 . A A . 5 ARG H 1 1 16 1966 1 1 5 ARG HA H 0.202 4.411 -1.185 1.00 . A A . 5 ARG HA 1 1 16 1967 1 1 5 ARG HB2 H 2.250 2.735 -0.911 1.00 . A A . 5 ARG HB2 1 1 16 1968 1 1 5 ARG HB3 H 2.889 3.686 -2.257 1.00 . A A . 5 ARG HB3 1 1 16 1969 1 1 5 ARG HD2 H 4.536 5.471 -1.157 1.00 . A A . 5 ARG HD2 1 1 16 1970 1 1 5 ARG HD3 H 3.153 5.952 -2.139 1.00 . A A . 5 ARG HD3 1 1 16 1971 1 1 5 ARG HE H 2.991 7.838 -0.873 1.00 . A A . 5 ARG HE 1 1 16 1972 1 1 5 ARG HG2 H 1.789 5.245 -0.017 1.00 . A A . 5 ARG HG2 1 1 16 1973 1 1 5 ARG HG3 H 3.237 4.303 0.345 1.00 . A A . 5 ARG HG3 1 1 16 1974 1 1 5 ARG HH11 H 4.755 5.446 0.956 1.00 . A A . 5 ARG HH11 1 1 16 1975 1 1 5 ARG HH12 H 5.109 6.525 2.263 1.00 . A A . 5 ARG HH12 1 1 16 1976 1 1 5 ARG HH21 H 3.456 9.259 0.845 1.00 . A A . 5 ARG HH21 1 1 16 1977 1 1 5 ARG HH22 H 4.372 8.690 2.201 1.00 . A A . 5 ARG HH22 1 1 16 1978 1 1 5 ARG N N 0.147 2.622 -2.211 1.00 . A A . 5 ARG N 1 1 16 1979 1 1 5 ARG NE N 3.468 7.102 -0.434 1.00 . A A . 5 ARG NE 1 1 16 1980 1 1 5 ARG NH1 N 4.686 6.352 1.374 1.00 . A A . 5 ARG NH1 1 1 16 1981 1 1 5 ARG NH2 N 3.947 8.523 1.311 1.00 . A A . 5 ARG NH2 1 1 16 1982 1 1 5 ARG O O 0.763 4.262 -4.316 1.00 . A A . 5 ARG O 1 1 16 1983 1 1 6 HIS C C 1.895 8.179 -3.819 1.00 . A A . 6 HIS C 1 1 16 1984 1 1 6 HIS CA C 0.948 7.021 -4.117 1.00 . A A . 6 HIS CA 1 1 16 1985 1 1 6 HIS CB C -0.453 7.555 -4.414 1.00 . A A . 6 HIS CB 1 1 16 1986 1 1 6 HIS CD2 C -1.246 7.935 -1.973 1.00 . A A . 6 HIS CD2 1 1 16 1987 1 1 6 HIS CE1 C -2.053 9.960 -2.211 1.00 . A A . 6 HIS CE1 1 1 16 1988 1 1 6 HIS CG C -1.066 8.296 -3.266 1.00 . A A . 6 HIS CG 1 1 16 1989 1 1 6 HIS H H 0.947 6.429 -2.085 1.00 . A A . 6 HIS H 1 1 16 1990 1 1 6 HIS HA H 1.312 6.489 -4.984 1.00 . A A . 6 HIS HA 1 1 16 1991 1 1 6 HIS HB2 H -0.401 8.234 -5.257 1.00 . A A . 6 HIS HB2 1 1 16 1992 1 1 6 HIS HB3 H -1.103 6.723 -4.661 1.00 . A A . 6 HIS HB3 1 1 16 1993 1 1 6 HIS HD1 H -1.602 10.108 -4.201 1.00 . A A . 6 HIS HD1 1 1 16 1994 1 1 6 HIS HD2 H -0.959 6.995 -1.524 1.00 . A A . 6 HIS HD2 1 1 16 1995 1 1 6 HIS HE1 H -2.516 10.913 -2.001 1.00 . A A . 6 HIS HE1 1 1 16 1996 1 1 6 HIS HE2 H -2.192 8.981 -0.417 1.00 . A A . 6 HIS HE2 1 1 16 1997 1 1 6 HIS N N 0.907 6.083 -3.001 1.00 . A A . 6 HIS N 1 1 16 1998 1 1 6 HIS ND1 N -1.583 9.569 -3.382 1.00 . A A . 6 HIS ND1 1 1 16 1999 1 1 6 HIS NE2 N -1.861 8.987 -1.340 1.00 . A A . 6 HIS NE2 1 1 16 2000 1 1 6 HIS O O 1.693 8.857 -2.790 1.00 . A A . 6 HIS O 1 1 17 2001 1 1 1 HIS C C 0.197 -6.476 3.114 1.00 . A A . 1 HIS C 1 1 17 2002 1 1 1 HIS CA C 0.390 -7.889 2.572 1.00 . A A . 1 HIS CA 1 1 17 2003 1 1 1 HIS CB C 1.871 -8.269 2.604 1.00 . A A . 1 HIS CB 1 1 17 2004 1 1 1 HIS CD2 C 1.880 -8.704 5.162 1.00 . A A . 1 HIS CD2 1 1 17 2005 1 1 1 HIS CE1 C 3.429 -10.254 5.218 1.00 . A A . 1 HIS CE1 1 1 17 2006 1 1 1 HIS CG C 2.298 -8.908 3.890 1.00 . A A . 1 HIS CG 1 1 17 2007 1 1 1 HIS H1 H -0.228 -9.006 0.959 1.00 . A A . 1 HIS H1 1 1 17 2008 1 1 1 HIS H2 H 0.625 -7.574 0.553 1.00 . A A . 1 HIS H2 1 1 17 2009 1 1 1 HIS H3 H -0.996 -7.481 1.107 1.00 . A A . 1 HIS H3 1 1 17 2010 1 1 1 HIS HA H -0.169 -8.580 3.184 1.00 . A A . 1 HIS HA 1 1 17 2011 1 1 1 HIS HB2 H 2.074 -8.966 1.805 1.00 . A A . 1 HIS HB2 1 1 17 2012 1 1 1 HIS HB3 H 2.467 -7.380 2.460 1.00 . A A . 1 HIS HB3 1 1 17 2013 1 1 1 HIS HD1 H 3.766 -10.252 3.200 1.00 . A A . 1 HIS HD1 1 1 17 2014 1 1 1 HIS HD2 H 1.122 -8.003 5.483 1.00 . A A . 1 HIS HD2 1 1 17 2015 1 1 1 HIS HE1 H 4.122 -11.002 5.573 1.00 . A A . 1 HIS HE1 1 1 17 2016 1 1 1 HIS HE2 H 2.573 -9.566 6.946 1.00 . A A . 1 HIS HE2 1 1 17 2017 1 1 1 HIS N N -0.096 -7.997 1.171 1.00 . A A . 1 HIS N 1 1 17 2018 1 1 1 HIS ND1 N 3.269 -9.884 3.960 1.00 . A A . 1 HIS ND1 1 1 17 2019 1 1 1 HIS NE2 N 2.599 -9.553 5.967 1.00 . A A . 1 HIS NE2 1 1 17 2020 1 1 1 HIS O O -0.046 -6.286 4.306 1.00 . A A . 1 HIS O 1 1 17 2021 1 1 2 ARG C C -0.797 -3.368 1.668 1.00 . A A . 2 ARG C 1 1 17 2022 1 1 2 ARG CA C 0.146 -4.093 2.622 1.00 . A A . 2 ARG CA 1 1 17 2023 1 1 2 ARG CB C 1.503 -3.388 2.652 1.00 . A A . 2 ARG CB 1 1 17 2024 1 1 2 ARG CD C 2.718 -2.358 4.600 1.00 . A A . 2 ARG CD 1 1 17 2025 1 1 2 ARG CG C 1.561 -2.219 3.623 1.00 . A A . 2 ARG CG 1 1 17 2026 1 1 2 ARG CZ C 3.741 -0.993 6.379 1.00 . A A . 2 ARG CZ 1 1 17 2027 1 1 2 ARG H H 0.503 -5.704 1.296 1.00 . A A . 2 ARG H 1 1 17 2028 1 1 2 ARG HA H -0.282 -4.074 3.613 1.00 . A A . 2 ARG HA 1 1 17 2029 1 1 2 ARG HB2 H 2.261 -4.104 2.935 1.00 . A A . 2 ARG HB2 1 1 17 2030 1 1 2 ARG HB3 H 1.724 -3.017 1.662 1.00 . A A . 2 ARG HB3 1 1 17 2031 1 1 2 ARG HD2 H 2.450 -3.083 5.354 1.00 . A A . 2 ARG HD2 1 1 17 2032 1 1 2 ARG HD3 H 3.587 -2.704 4.061 1.00 . A A . 2 ARG HD3 1 1 17 2033 1 1 2 ARG HE H 2.711 -0.269 4.831 1.00 . A A . 2 ARG HE 1 1 17 2034 1 1 2 ARG HG2 H 1.684 -1.304 3.063 1.00 . A A . 2 ARG HG2 1 1 17 2035 1 1 2 ARG HG3 H 0.635 -2.180 4.179 1.00 . A A . 2 ARG HG3 1 1 17 2036 1 1 2 ARG HH11 H 4.018 -2.986 6.588 1.00 . A A . 2 ARG HH11 1 1 17 2037 1 1 2 ARG HH12 H 4.728 -2.004 7.825 1.00 . A A . 2 ARG HH12 1 1 17 2038 1 1 2 ARG HH21 H 3.644 1.024 6.457 1.00 . A A . 2 ARG HH21 1 1 17 2039 1 1 2 ARG HH22 H 4.515 0.272 7.751 1.00 . A A . 2 ARG HH22 1 1 17 2040 1 1 2 ARG N N 0.308 -5.489 2.232 1.00 . A A . 2 ARG N 1 1 17 2041 1 1 2 ARG NE N 3.038 -1.091 5.253 1.00 . A A . 2 ARG NE 1 1 17 2042 1 1 2 ARG NH1 N 4.200 -2.085 6.979 1.00 . A A . 2 ARG NH1 1 1 17 2043 1 1 2 ARG NH2 N 3.987 0.198 6.905 1.00 . A A . 2 ARG NH2 1 1 17 2044 1 1 2 ARG O O -1.226 -3.927 0.659 1.00 . A A . 2 ARG O 1 1 17 2045 1 1 3 PHE C C -1.243 -0.612 0.056 1.00 . A A . 3 PHE C 1 1 17 2046 1 1 3 PHE CA C -2.009 -1.319 1.167 1.00 . A A . 3 PHE CA 1 1 17 2047 1 1 3 PHE CB C -2.759 -0.300 2.022 1.00 . A A . 3 PHE CB 1 1 17 2048 1 1 3 PHE CD1 C -4.939 -1.424 1.439 1.00 . A A . 3 PHE CD1 1 1 17 2049 1 1 3 PHE CD2 C -4.952 0.915 1.904 1.00 . A A . 3 PHE CD2 1 1 17 2050 1 1 3 PHE CE1 C -6.304 -1.392 1.223 1.00 . A A . 3 PHE CE1 1 1 17 2051 1 1 3 PHE CE2 C -6.317 0.953 1.688 1.00 . A A . 3 PHE CE2 1 1 17 2052 1 1 3 PHE CG C -4.247 -0.271 1.782 1.00 . A A . 3 PHE CG 1 1 17 2053 1 1 3 PHE CZ C -6.993 -0.202 1.347 1.00 . A A . 3 PHE CZ 1 1 17 2054 1 1 3 PHE H H -0.743 -1.729 2.812 1.00 . A A . 3 PHE H 1 1 17 2055 1 1 3 PHE HA H -2.720 -1.982 0.717 1.00 . A A . 3 PHE HA 1 1 17 2056 1 1 3 PHE HB2 H -2.597 -0.528 3.069 1.00 . A A . 3 PHE HB2 1 1 17 2057 1 1 3 PHE HB3 H -2.371 0.683 1.804 1.00 . A A . 3 PHE HB3 1 1 17 2058 1 1 3 PHE HD1 H -4.402 -2.356 1.340 1.00 . A A . 3 PHE HD1 1 1 17 2059 1 1 3 PHE HD2 H -4.426 1.820 2.170 1.00 . A A . 3 PHE HD2 1 1 17 2060 1 1 3 PHE HE1 H -6.830 -2.296 0.956 1.00 . A A . 3 PHE HE1 1 1 17 2061 1 1 3 PHE HE2 H -6.854 1.885 1.785 1.00 . A A . 3 PHE HE2 1 1 17 2062 1 1 3 PHE HZ H -8.060 -0.175 1.178 1.00 . A A . 3 PHE HZ 1 1 17 2063 1 1 3 PHE N N -1.116 -2.120 1.994 1.00 . A A . 3 PHE N 1 1 17 2064 1 1 3 PHE O O -0.012 -0.611 0.037 1.00 . A A . 3 PHE O 1 1 17 2065 1 1 4 LEU C C -1.008 2.112 -1.615 1.00 . A A . 4 LEU C 1 1 17 2066 1 1 4 LEU CA C -1.383 0.684 -1.997 1.00 . A A . 4 LEU CA 1 1 17 2067 1 1 4 LEU CB C -2.337 0.692 -3.190 1.00 . A A . 4 LEU CB 1 1 17 2068 1 1 4 LEU CD1 C -4.296 -0.767 -2.658 1.00 . A A . 4 LEU CD1 1 1 17 2069 1 1 4 LEU CD2 C -3.304 -0.801 -4.956 1.00 . A A . 4 LEU CD2 1 1 17 2070 1 1 4 LEU CG C -3.019 -0.646 -3.470 1.00 . A A . 4 LEU CG 1 1 17 2071 1 1 4 LEU H H -2.959 -0.062 -0.802 1.00 . A A . 4 LEU H 1 1 17 2072 1 1 4 LEU HA H -0.491 0.151 -2.273 1.00 . A A . 4 LEU HA 1 1 17 2073 1 1 4 LEU HB2 H -3.102 1.434 -3.009 1.00 . A A . 4 LEU HB2 1 1 17 2074 1 1 4 LEU HB3 H -1.780 0.979 -4.069 1.00 . A A . 4 LEU HB3 1 1 17 2075 1 1 4 LEU HD11 H -4.447 0.140 -2.093 1.00 . A A . 4 LEU HD11 1 1 17 2076 1 1 4 LEU HD12 H -4.208 -1.602 -1.979 1.00 . A A . 4 LEU HD12 1 1 17 2077 1 1 4 LEU HD13 H -5.133 -0.926 -3.320 1.00 . A A . 4 LEU HD13 1 1 17 2078 1 1 4 LEU HD21 H -3.172 -1.834 -5.242 1.00 . A A . 4 LEU HD21 1 1 17 2079 1 1 4 LEU HD22 H -2.622 -0.182 -5.520 1.00 . A A . 4 LEU HD22 1 1 17 2080 1 1 4 LEU HD23 H -4.319 -0.497 -5.162 1.00 . A A . 4 LEU HD23 1 1 17 2081 1 1 4 LEU HG H -2.359 -1.447 -3.167 1.00 . A A . 4 LEU HG 1 1 17 2082 1 1 4 LEU N N -1.984 -0.020 -0.873 1.00 . A A . 4 LEU N 1 1 17 2083 1 1 4 LEU O O -1.725 2.773 -0.864 1.00 . A A . 4 LEU O 1 1 17 2084 1 1 5 ARG C C 0.800 4.721 -3.138 1.00 . A A . 5 ARG C 1 1 17 2085 1 1 5 ARG CA C 0.593 3.932 -1.849 1.00 . A A . 5 ARG CA 1 1 17 2086 1 1 5 ARG CB C 1.899 3.879 -1.054 1.00 . A A . 5 ARG CB 1 1 17 2087 1 1 5 ARG CD C 3.123 6.070 -0.932 1.00 . A A . 5 ARG CD 1 1 17 2088 1 1 5 ARG CG C 2.157 5.130 -0.230 1.00 . A A . 5 ARG CG 1 1 17 2089 1 1 5 ARG CZ C 3.791 7.695 0.796 1.00 . A A . 5 ARG CZ 1 1 17 2090 1 1 5 ARG H H 0.650 2.006 -2.727 1.00 . A A . 5 ARG H 1 1 17 2091 1 1 5 ARG HA H -0.160 4.427 -1.255 1.00 . A A . 5 ARG HA 1 1 17 2092 1 1 5 ARG HB2 H 1.863 3.031 -0.380 1.00 . A A . 5 ARG HB2 1 1 17 2093 1 1 5 ARG HB3 H 2.723 3.752 -1.746 1.00 . A A . 5 ARG HB3 1 1 17 2094 1 1 5 ARG HD2 H 4.117 5.651 -0.877 1.00 . A A . 5 ARG HD2 1 1 17 2095 1 1 5 ARG HD3 H 2.829 6.162 -1.967 1.00 . A A . 5 ARG HD3 1 1 17 2096 1 1 5 ARG HE H 2.627 8.106 -0.772 1.00 . A A . 5 ARG HE 1 1 17 2097 1 1 5 ARG HG2 H 1.221 5.645 -0.072 1.00 . A A . 5 ARG HG2 1 1 17 2098 1 1 5 ARG HG3 H 2.577 4.841 0.722 1.00 . A A . 5 ARG HG3 1 1 17 2099 1 1 5 ARG HH11 H 4.526 5.830 1.071 1.00 . A A . 5 ARG HH11 1 1 17 2100 1 1 5 ARG HH12 H 4.981 6.991 2.272 1.00 . A A . 5 ARG HH12 1 1 17 2101 1 1 5 ARG HH21 H 3.225 9.634 0.807 1.00 . A A . 5 ARG HH21 1 1 17 2102 1 1 5 ARG HH22 H 4.242 9.151 2.123 1.00 . A A . 5 ARG HH22 1 1 17 2103 1 1 5 ARG N N 0.121 2.582 -2.136 1.00 . A A . 5 ARG N 1 1 17 2104 1 1 5 ARG NE N 3.135 7.398 -0.323 1.00 . A A . 5 ARG NE 1 1 17 2105 1 1 5 ARG NH1 N 4.490 6.762 1.432 1.00 . A A . 5 ARG NH1 1 1 17 2106 1 1 5 ARG NH2 N 3.749 8.928 1.282 1.00 . A A . 5 ARG NH2 1 1 17 2107 1 1 5 ARG O O 1.020 4.144 -4.203 1.00 . A A . 5 ARG O 1 1 17 2108 1 1 6 HIS C C 2.173 7.755 -4.046 1.00 . A A . 6 HIS C 1 1 17 2109 1 1 6 HIS CA C 0.908 6.915 -4.189 1.00 . A A . 6 HIS CA 1 1 17 2110 1 1 6 HIS CB C -0.307 7.827 -4.362 1.00 . A A . 6 HIS CB 1 1 17 2111 1 1 6 HIS CD2 C -1.477 8.165 -2.071 1.00 . A A . 6 HIS CD2 1 1 17 2112 1 1 6 HIS CE1 C -0.767 10.195 -1.646 1.00 . A A . 6 HIS CE1 1 1 17 2113 1 1 6 HIS CG C -0.695 8.548 -3.108 1.00 . A A . 6 HIS CG 1 1 17 2114 1 1 6 HIS H H 0.551 6.445 -2.156 1.00 . A A . 6 HIS H 1 1 17 2115 1 1 6 HIS HA H 1.004 6.288 -5.064 1.00 . A A . 6 HIS HA 1 1 17 2116 1 1 6 HIS HB2 H -0.087 8.571 -5.118 1.00 . A A . 6 HIS HB2 1 1 17 2117 1 1 6 HIS HB3 H -1.155 7.230 -4.679 1.00 . A A . 6 HIS HB3 1 1 17 2118 1 1 6 HIS HD1 H 0.318 10.377 -3.371 1.00 . A A . 6 HIS HD1 1 1 17 2119 1 1 6 HIS HD2 H -1.984 7.216 -1.967 1.00 . A A . 6 HIS HD2 1 1 17 2120 1 1 6 HIS HE1 H -0.602 11.145 -1.160 1.00 . A A . 6 HIS HE1 1 1 17 2121 1 1 6 HIS HE2 H -2.062 9.250 -0.371 1.00 . A A . 6 HIS HE2 1 1 17 2122 1 1 6 HIS N N 0.728 6.044 -3.033 1.00 . A A . 6 HIS N 1 1 17 2123 1 1 6 HIS ND1 N -0.267 9.825 -2.811 1.00 . A A . 6 HIS ND1 1 1 17 2124 1 1 6 HIS NE2 N -1.506 9.206 -1.177 1.00 . A A . 6 HIS NE2 1 1 17 2125 1 1 6 HIS O O 2.243 8.558 -3.091 1.00 . A A . 6 HIS O 1 1 18 2126 1 1 1 HIS C C -0.168 -6.764 3.312 1.00 . A A . 1 HIS C 1 1 18 2127 1 1 1 HIS CA C -0.706 -8.184 3.172 1.00 . A A . 1 HIS CA 1 1 18 2128 1 1 1 HIS CB C -0.912 -8.808 4.553 1.00 . A A . 1 HIS CB 1 1 18 2129 1 1 1 HIS CD2 C -1.313 -11.281 5.228 1.00 . A A . 1 HIS CD2 1 1 18 2130 1 1 1 HIS CE1 C -2.946 -11.731 3.837 1.00 . A A . 1 HIS CE1 1 1 18 2131 1 1 1 HIS CG C -1.556 -10.159 4.509 1.00 . A A . 1 HIS CG 1 1 18 2132 1 1 1 HIS H1 H 1.106 -9.133 2.954 1.00 . A A . 1 HIS H1 1 1 18 2133 1 1 1 HIS H2 H 0.411 -8.572 1.489 1.00 . A A . 1 HIS H2 1 1 18 2134 1 1 1 HIS H3 H -0.224 -9.965 2.263 1.00 . A A . 1 HIS H3 1 1 18 2135 1 1 1 HIS HA H -1.652 -8.152 2.652 1.00 . A A . 1 HIS HA 1 1 18 2136 1 1 1 HIS HB2 H 0.046 -8.914 5.039 1.00 . A A . 1 HIS HB2 1 1 18 2137 1 1 1 HIS HB3 H -1.540 -8.158 5.145 1.00 . A A . 1 HIS HB3 1 1 18 2138 1 1 1 HIS HD1 H -2.989 -9.868 2.992 1.00 . A A . 1 HIS HD1 1 1 18 2139 1 1 1 HIS HD2 H -0.568 -11.397 6.002 1.00 . A A . 1 HIS HD2 1 1 18 2140 1 1 1 HIS HE1 H -3.727 -12.252 3.302 1.00 . A A . 1 HIS HE1 1 1 18 2141 1 1 1 HIS HE2 H -2.306 -13.131 5.188 1.00 . A A . 1 HIS HE2 1 1 18 2142 1 1 1 HIS N N 0.231 -9.041 2.400 1.00 . A A . 1 HIS N 1 1 18 2143 1 1 1 HIS ND1 N -2.584 -10.475 3.646 1.00 . A A . 1 HIS ND1 1 1 18 2144 1 1 1 HIS NE2 N -2.190 -12.242 4.790 1.00 . A A . 1 HIS NE2 1 1 18 2145 1 1 1 HIS O O 0.382 -6.397 4.351 1.00 . A A . 1 HIS O 1 1 18 2146 1 1 2 ARG C C -0.815 -3.685 1.492 1.00 . A A . 2 ARG C 1 1 18 2147 1 1 2 ARG CA C 0.141 -4.588 2.265 1.00 . A A . 2 ARG CA 1 1 18 2148 1 1 2 ARG CB C 1.544 -4.502 1.661 1.00 . A A . 2 ARG CB 1 1 18 2149 1 1 2 ARG CD C 3.812 -5.582 1.725 1.00 . A A . 2 ARG CD 1 1 18 2150 1 1 2 ARG CG C 2.625 -5.102 2.545 1.00 . A A . 2 ARG CG 1 1 18 2151 1 1 2 ARG CZ C 4.117 -7.939 2.376 1.00 . A A . 2 ARG CZ 1 1 18 2152 1 1 2 ARG H H -0.776 -6.318 1.460 1.00 . A A . 2 ARG H 1 1 18 2153 1 1 2 ARG HA H 0.179 -4.255 3.292 1.00 . A A . 2 ARG HA 1 1 18 2154 1 1 2 ARG HB2 H 1.549 -5.026 0.717 1.00 . A A . 2 ARG HB2 1 1 18 2155 1 1 2 ARG HB3 H 1.786 -3.464 1.488 1.00 . A A . 2 ARG HB3 1 1 18 2156 1 1 2 ARG HD2 H 3.455 -5.926 0.766 1.00 . A A . 2 ARG HD2 1 1 18 2157 1 1 2 ARG HD3 H 4.490 -4.754 1.580 1.00 . A A . 2 ARG HD3 1 1 18 2158 1 1 2 ARG HE H 5.357 -6.450 2.854 1.00 . A A . 2 ARG HE 1 1 18 2159 1 1 2 ARG HG2 H 2.963 -4.352 3.244 1.00 . A A . 2 ARG HG2 1 1 18 2160 1 1 2 ARG HG3 H 2.210 -5.940 3.086 1.00 . A A . 2 ARG HG3 1 1 18 2161 1 1 2 ARG HH11 H 2.459 -7.582 1.274 1.00 . A A . 2 ARG HH11 1 1 18 2162 1 1 2 ARG HH12 H 2.696 -9.232 1.746 1.00 . A A . 2 ARG HH12 1 1 18 2163 1 1 2 ARG HH21 H 5.671 -8.619 3.476 1.00 . A A . 2 ARG HH21 1 1 18 2164 1 1 2 ARG HH22 H 4.519 -9.820 2.996 1.00 . A A . 2 ARG HH22 1 1 18 2165 1 1 2 ARG N N -0.329 -5.968 2.260 1.00 . A A . 2 ARG N 1 1 18 2166 1 1 2 ARG NE N 4.527 -6.673 2.383 1.00 . A A . 2 ARG NE 1 1 18 2167 1 1 2 ARG NH1 N 2.999 -8.278 1.747 1.00 . A A . 2 ARG NH1 1 1 18 2168 1 1 2 ARG NH2 N 4.827 -8.869 3.000 1.00 . A A . 2 ARG NH2 1 1 18 2169 1 1 2 ARG O O -1.669 -4.163 0.746 1.00 . A A . 2 ARG O 1 1 18 2170 1 1 3 PHE C C -0.747 -0.678 -0.098 1.00 . A A . 3 PHE C 1 1 18 2171 1 1 3 PHE CA C -1.515 -1.407 0.997 1.00 . A A . 3 PHE CA 1 1 18 2172 1 1 3 PHE CB C -2.086 -0.404 1.998 1.00 . A A . 3 PHE CB 1 1 18 2173 1 1 3 PHE CD1 C -4.413 -1.267 1.565 1.00 . A A . 3 PHE CD1 1 1 18 2174 1 1 3 PHE CD2 C -4.136 1.040 2.106 1.00 . A A . 3 PHE CD2 1 1 18 2175 1 1 3 PHE CE1 C -5.779 -1.083 1.466 1.00 . A A . 3 PHE CE1 1 1 18 2176 1 1 3 PHE CE2 C -5.502 1.229 2.008 1.00 . A A . 3 PHE CE2 1 1 18 2177 1 1 3 PHE CG C -3.575 -0.208 1.886 1.00 . A A . 3 PHE CG 1 1 18 2178 1 1 3 PHE CZ C -6.324 0.167 1.687 1.00 . A A . 3 PHE CZ 1 1 18 2179 1 1 3 PHE H H 0.033 -2.057 2.286 1.00 . A A . 3 PHE H 1 1 18 2180 1 1 3 PHE HA H -2.327 -1.942 0.544 1.00 . A A . 3 PHE HA 1 1 18 2181 1 1 3 PHE HB2 H -1.871 -0.745 3.004 1.00 . A A . 3 PHE HB2 1 1 18 2182 1 1 3 PHE HB3 H -1.614 0.552 1.833 1.00 . A A . 3 PHE HB3 1 1 18 2183 1 1 3 PHE HD1 H -3.988 -2.244 1.391 1.00 . A A . 3 PHE HD1 1 1 18 2184 1 1 3 PHE HD2 H -3.495 1.872 2.357 1.00 . A A . 3 PHE HD2 1 1 18 2185 1 1 3 PHE HE1 H -6.419 -1.915 1.214 1.00 . A A . 3 PHE HE1 1 1 18 2186 1 1 3 PHE HE2 H -5.925 2.207 2.181 1.00 . A A . 3 PHE HE2 1 1 18 2187 1 1 3 PHE HZ H -7.391 0.313 1.610 1.00 . A A . 3 PHE HZ 1 1 18 2188 1 1 3 PHE N N -0.665 -2.377 1.677 1.00 . A A . 3 PHE N 1 1 18 2189 1 1 3 PHE O O 0.473 -0.803 -0.206 1.00 . A A . 3 PHE O 1 1 18 2190 1 1 4 LEU C C -0.660 2.288 -1.627 1.00 . A A . 4 LEU C 1 1 18 2191 1 1 4 LEU CA C -0.865 0.826 -2.007 1.00 . A A . 4 LEU CA 1 1 18 2192 1 1 4 LEU CB C -1.725 0.725 -3.266 1.00 . A A . 4 LEU CB 1 1 18 2193 1 1 4 LEU CD1 C -3.734 -0.621 -2.647 1.00 . A A . 4 LEU CD1 1 1 18 2194 1 1 4 LEU CD2 C -2.711 -0.885 -4.917 1.00 . A A . 4 LEU CD2 1 1 18 2195 1 1 4 LEU CG C -2.443 -0.611 -3.444 1.00 . A A . 4 LEU CG 1 1 18 2196 1 1 4 LEU H H -2.440 0.134 -0.777 1.00 . A A . 4 LEU H 1 1 18 2197 1 1 4 LEU HA H 0.092 0.380 -2.207 1.00 . A A . 4 LEU HA 1 1 18 2198 1 1 4 LEU HB2 H -2.466 1.510 -3.235 1.00 . A A . 4 LEU HB2 1 1 18 2199 1 1 4 LEU HB3 H -1.091 0.884 -4.125 1.00 . A A . 4 LEU HB3 1 1 18 2200 1 1 4 LEU HD11 H -3.701 -1.423 -1.926 1.00 . A A . 4 LEU HD11 1 1 18 2201 1 1 4 LEU HD12 H -4.571 -0.767 -3.313 1.00 . A A . 4 LEU HD12 1 1 18 2202 1 1 4 LEU HD13 H -3.841 0.321 -2.131 1.00 . A A . 4 LEU HD13 1 1 18 2203 1 1 4 LEU HD21 H -1.882 -0.523 -5.507 1.00 . A A . 4 LEU HD21 1 1 18 2204 1 1 4 LEU HD22 H -3.616 -0.379 -5.218 1.00 . A A . 4 LEU HD22 1 1 18 2205 1 1 4 LEU HD23 H -2.825 -1.948 -5.070 1.00 . A A . 4 LEU HD23 1 1 18 2206 1 1 4 LEU HG H -1.815 -1.402 -3.061 1.00 . A A . 4 LEU HG 1 1 18 2207 1 1 4 LEU N N -1.473 0.080 -0.913 1.00 . A A . 4 LEU N 1 1 18 2208 1 1 4 LEU O O -1.348 2.816 -0.753 1.00 . A A . 4 LEU O 1 1 18 2209 1 1 5 ARG C C 0.657 5.141 -3.320 1.00 . A A . 5 ARG C 1 1 18 2210 1 1 5 ARG CA C 0.587 4.341 -2.022 1.00 . A A . 5 ARG CA 1 1 18 2211 1 1 5 ARG CB C 1.907 4.468 -1.260 1.00 . A A . 5 ARG CB 1 1 18 2212 1 1 5 ARG CD C 2.729 6.760 -0.643 1.00 . A A . 5 ARG CD 1 1 18 2213 1 1 5 ARG CG C 1.899 5.565 -0.208 1.00 . A A . 5 ARG CG 1 1 18 2214 1 1 5 ARG CZ C 4.875 6.375 0.504 1.00 . A A . 5 ARG CZ 1 1 18 2215 1 1 5 ARG H H 0.806 2.464 -2.976 1.00 . A A . 5 ARG H 1 1 18 2216 1 1 5 ARG HA H -0.210 4.738 -1.412 1.00 . A A . 5 ARG HA 1 1 18 2217 1 1 5 ARG HB2 H 2.116 3.528 -0.766 1.00 . A A . 5 ARG HB2 1 1 18 2218 1 1 5 ARG HB3 H 2.700 4.683 -1.969 1.00 . A A . 5 ARG HB3 1 1 18 2219 1 1 5 ARG HD2 H 2.447 7.029 -1.650 1.00 . A A . 5 ARG HD2 1 1 18 2220 1 1 5 ARG HD3 H 2.523 7.586 0.021 1.00 . A A . 5 ARG HD3 1 1 18 2221 1 1 5 ARG HE H 4.614 6.347 -1.474 1.00 . A A . 5 ARG HE 1 1 18 2222 1 1 5 ARG HG2 H 0.881 5.886 -0.045 1.00 . A A . 5 ARG HG2 1 1 18 2223 1 1 5 ARG HG3 H 2.305 5.171 0.712 1.00 . A A . 5 ARG HG3 1 1 18 2224 1 1 5 ARG HH11 H 3.317 6.738 1.742 1.00 . A A . 5 ARG HH11 1 1 18 2225 1 1 5 ARG HH12 H 4.838 6.465 2.523 1.00 . A A . 5 ARG HH12 1 1 18 2226 1 1 5 ARG HH21 H 6.615 5.987 -0.448 1.00 . A A . 5 ARG HH21 1 1 18 2227 1 1 5 ARG HH22 H 6.711 6.039 1.280 1.00 . A A . 5 ARG HH22 1 1 18 2228 1 1 5 ARG N N 0.291 2.939 -2.290 1.00 . A A . 5 ARG N 1 1 18 2229 1 1 5 ARG NE N 4.161 6.473 -0.615 1.00 . A A . 5 ARG NE 1 1 18 2230 1 1 5 ARG NH1 N 4.295 6.540 1.687 1.00 . A A . 5 ARG NH1 1 1 18 2231 1 1 5 ARG NH2 N 6.173 6.112 0.440 1.00 . A A . 5 ARG NH2 1 1 18 2232 1 1 5 ARG O O 0.730 4.571 -4.408 1.00 . A A . 5 ARG O 1 1 18 2233 1 1 6 HIS C C 1.435 8.634 -4.026 1.00 . A A . 6 HIS C 1 1 18 2234 1 1 6 HIS CA C 0.697 7.342 -4.358 1.00 . A A . 6 HIS CA 1 1 18 2235 1 1 6 HIS CB C -0.713 7.660 -4.858 1.00 . A A . 6 HIS CB 1 1 18 2236 1 1 6 HIS CD2 C -1.312 9.000 -2.719 1.00 . A A . 6 HIS CD2 1 1 18 2237 1 1 6 HIS CE1 C -3.484 8.704 -2.755 1.00 . A A . 6 HIS CE1 1 1 18 2238 1 1 6 HIS CG C -1.602 8.245 -3.806 1.00 . A A . 6 HIS CG 1 1 18 2239 1 1 6 HIS H H 0.576 6.859 -2.301 1.00 . A A . 6 HIS H 1 1 18 2240 1 1 6 HIS HA H 1.237 6.823 -5.136 1.00 . A A . 6 HIS HA 1 1 18 2241 1 1 6 HIS HB2 H -0.647 8.373 -5.671 1.00 . A A . 6 HIS HB2 1 1 18 2242 1 1 6 HIS HB3 H -1.175 6.746 -5.216 1.00 . A A . 6 HIS HB3 1 1 18 2243 1 1 6 HIS HD1 H -3.490 7.574 -4.460 1.00 . A A . 6 HIS HD1 1 1 18 2244 1 1 6 HIS HD2 H -0.330 9.328 -2.410 1.00 . A A . 6 HIS HD2 1 1 18 2245 1 1 6 HIS HE1 H -4.532 8.744 -2.494 1.00 . A A . 6 HIS HE1 1 1 18 2246 1 1 6 HIS HE2 H -2.610 9.871 -1.317 1.00 . A A . 6 HIS HE2 1 1 18 2247 1 1 6 HIS N N 0.635 6.464 -3.195 1.00 . A A . 6 HIS N 1 1 18 2248 1 1 6 HIS ND1 N -2.971 8.077 -3.798 1.00 . A A . 6 HIS ND1 1 1 18 2249 1 1 6 HIS NE2 N -2.499 9.272 -2.084 1.00 . A A . 6 HIS NE2 1 1 18 2250 1 1 6 HIS O O 1.629 9.457 -4.945 1.00 . A A . 6 HIS O 1 1 19 2251 1 1 1 HIS C C 0.254 -6.476 3.155 1.00 . A A . 1 HIS C 1 1 19 2252 1 1 1 HIS CA C -0.224 -7.925 3.159 1.00 . A A . 1 HIS CA 1 1 19 2253 1 1 1 HIS CB C -0.381 -8.427 4.596 1.00 . A A . 1 HIS CB 1 1 19 2254 1 1 1 HIS CD2 C -2.951 -8.699 4.369 1.00 . A A . 1 HIS CD2 1 1 19 2255 1 1 1 HIS CE1 C -3.491 -8.413 6.475 1.00 . A A . 1 HIS CE1 1 1 19 2256 1 1 1 HIS CG C -1.805 -8.484 5.057 1.00 . A A . 1 HIS CG 1 1 19 2257 1 1 1 HIS H1 H 1.694 -8.559 2.772 1.00 . A A . 1 HIS H1 1 1 19 2258 1 1 1 HIS H2 H 0.627 -8.645 1.430 1.00 . A A . 1 HIS H2 1 1 19 2259 1 1 1 HIS H3 H 0.506 -9.793 2.701 1.00 . A A . 1 HIS H3 1 1 19 2260 1 1 1 HIS HA H -1.178 -7.982 2.657 1.00 . A A . 1 HIS HA 1 1 19 2261 1 1 1 HIS HB2 H 0.031 -9.422 4.669 1.00 . A A . 1 HIS HB2 1 1 19 2262 1 1 1 HIS HB3 H 0.159 -7.769 5.262 1.00 . A A . 1 HIS HB3 1 1 19 2263 1 1 1 HIS HD1 H -1.570 -8.132 7.122 1.00 . A A . 1 HIS HD1 1 1 19 2264 1 1 1 HIS HD2 H -3.038 -8.876 3.306 1.00 . A A . 1 HIS HD2 1 1 19 2265 1 1 1 HIS HE1 H -4.064 -8.320 7.386 1.00 . A A . 1 HIS HE1 1 1 19 2266 1 1 1 HIS HE2 H -4.938 -8.685 5.051 1.00 . A A . 1 HIS HE2 1 1 19 2267 1 1 1 HIS N N 0.737 -8.810 2.452 1.00 . A A . 1 HIS N 1 1 19 2268 1 1 1 HIS ND1 N -2.178 -8.307 6.373 1.00 . A A . 1 HIS ND1 1 1 19 2269 1 1 1 HIS NE2 N -3.984 -8.649 5.273 1.00 . A A . 1 HIS NE2 1 1 19 2270 1 1 1 HIS O O 0.951 -6.040 4.071 1.00 . A A . 1 HIS O 1 1 19 2271 1 1 2 ARG C C -0.889 -3.496 1.457 1.00 . A A . 2 ARG C 1 1 19 2272 1 1 2 ARG CA C 0.263 -4.336 1.997 1.00 . A A . 2 ARG CA 1 1 19 2273 1 1 2 ARG CB C 1.481 -4.201 1.081 1.00 . A A . 2 ARG CB 1 1 19 2274 1 1 2 ARG CD C 3.414 -5.672 1.725 1.00 . A A . 2 ARG CD 1 1 19 2275 1 1 2 ARG CG C 2.808 -4.281 1.817 1.00 . A A . 2 ARG CG 1 1 19 2276 1 1 2 ARG CZ C 4.052 -7.262 -0.047 1.00 . A A . 2 ARG CZ 1 1 19 2277 1 1 2 ARG H H -0.683 -6.140 1.421 1.00 . A A . 2 ARG H 1 1 19 2278 1 1 2 ARG HA H 0.522 -3.977 2.981 1.00 . A A . 2 ARG HA 1 1 19 2279 1 1 2 ARG HB2 H 1.453 -4.992 0.345 1.00 . A A . 2 ARG HB2 1 1 19 2280 1 1 2 ARG HB3 H 1.432 -3.249 0.574 1.00 . A A . 2 ARG HB3 1 1 19 2281 1 1 2 ARG HD2 H 4.300 -5.707 2.341 1.00 . A A . 2 ARG HD2 1 1 19 2282 1 1 2 ARG HD3 H 2.694 -6.390 2.091 1.00 . A A . 2 ARG HD3 1 1 19 2283 1 1 2 ARG HE H 3.820 -5.296 -0.303 1.00 . A A . 2 ARG HE 1 1 19 2284 1 1 2 ARG HG2 H 3.495 -3.571 1.380 1.00 . A A . 2 ARG HG2 1 1 19 2285 1 1 2 ARG HG3 H 2.647 -4.036 2.857 1.00 . A A . 2 ARG HG3 1 1 19 2286 1 1 2 ARG HH11 H 3.764 -8.103 1.771 1.00 . A A . 2 ARG HH11 1 1 19 2287 1 1 2 ARG HH12 H 4.213 -9.200 0.508 1.00 . A A . 2 ARG HH12 1 1 19 2288 1 1 2 ARG HH21 H 4.410 -6.739 -1.966 1.00 . A A . 2 ARG HH21 1 1 19 2289 1 1 2 ARG HH22 H 4.579 -8.426 -1.613 1.00 . A A . 2 ARG HH22 1 1 19 2290 1 1 2 ARG N N -0.127 -5.736 2.119 1.00 . A A . 2 ARG N 1 1 19 2291 1 1 2 ARG NE N 3.778 -6.023 0.354 1.00 . A A . 2 ARG NE 1 1 19 2292 1 1 2 ARG NH1 N 4.006 -8.271 0.815 1.00 . A A . 2 ARG NH1 1 1 19 2293 1 1 2 ARG NH2 N 4.373 -7.495 -1.312 1.00 . A A . 2 ARG NH2 1 1 19 2294 1 1 2 ARG O O -1.936 -4.026 1.084 1.00 . A A . 2 ARG O 1 1 19 2295 1 1 3 PHE C C -1.219 -0.500 -0.293 1.00 . A A . 3 PHE C 1 1 19 2296 1 1 3 PHE CA C -1.712 -1.269 0.926 1.00 . A A . 3 PHE CA 1 1 19 2297 1 1 3 PHE CB C -2.136 -0.297 2.026 1.00 . A A . 3 PHE CB 1 1 19 2298 1 1 3 PHE CD1 C -4.444 -1.313 2.018 1.00 . A A . 3 PHE CD1 1 1 19 2299 1 1 3 PHE CD2 C -4.211 0.980 2.633 1.00 . A A . 3 PHE CD2 1 1 19 2300 1 1 3 PHE CE1 C -5.810 -1.228 2.206 1.00 . A A . 3 PHE CE1 1 1 19 2301 1 1 3 PHE CE2 C -5.577 1.070 2.823 1.00 . A A . 3 PHE CE2 1 1 19 2302 1 1 3 PHE CG C -3.627 -0.210 2.228 1.00 . A A . 3 PHE CG 1 1 19 2303 1 1 3 PHE CZ C -6.377 -0.035 2.609 1.00 . A A . 3 PHE CZ 1 1 19 2304 1 1 3 PHE H H 0.166 -1.820 1.731 1.00 . A A . 3 PHE H 1 1 19 2305 1 1 3 PHE HA H -2.562 -1.854 0.635 1.00 . A A . 3 PHE HA 1 1 19 2306 1 1 3 PHE HB2 H -1.693 -0.610 2.964 1.00 . A A . 3 PHE HB2 1 1 19 2307 1 1 3 PHE HB3 H -1.780 0.689 1.771 1.00 . A A . 3 PHE HB3 1 1 19 2308 1 1 3 PHE HD1 H -4.002 -2.247 1.701 1.00 . A A . 3 PHE HD1 1 1 19 2309 1 1 3 PHE HD2 H -3.587 1.845 2.800 1.00 . A A . 3 PHE HD2 1 1 19 2310 1 1 3 PHE HE1 H -6.434 -2.094 2.038 1.00 . A A . 3 PHE HE1 1 1 19 2311 1 1 3 PHE HE2 H -6.018 2.004 3.137 1.00 . A A . 3 PHE HE2 1 1 19 2312 1 1 3 PHE HZ H -7.445 0.033 2.757 1.00 . A A . 3 PHE HZ 1 1 19 2313 1 1 3 PHE N N -0.689 -2.183 1.419 1.00 . A A . 3 PHE N 1 1 19 2314 1 1 3 PHE O O -0.040 -0.555 -0.643 1.00 . A A . 3 PHE O 1 1 19 2315 1 1 4 LEU C C -1.360 2.392 -1.761 1.00 . A A . 4 LEU C 1 1 19 2316 1 1 4 LEU CA C -1.807 0.982 -2.129 1.00 . A A . 4 LEU CA 1 1 19 2317 1 1 4 LEU CB C -3.006 1.039 -3.073 1.00 . A A . 4 LEU CB 1 1 19 2318 1 1 4 LEU CD1 C -4.807 -0.416 -2.135 1.00 . A A . 4 LEU CD1 1 1 19 2319 1 1 4 LEU CD2 C -4.394 -0.385 -4.601 1.00 . A A . 4 LEU CD2 1 1 19 2320 1 1 4 LEU CG C -3.759 -0.282 -3.223 1.00 . A A . 4 LEU CG 1 1 19 2321 1 1 4 LEU H H -3.059 0.205 -0.614 1.00 . A A . 4 LEU H 1 1 19 2322 1 1 4 LEU HA H -1.000 0.478 -2.629 1.00 . A A . 4 LEU HA 1 1 19 2323 1 1 4 LEU HB2 H -3.695 1.785 -2.703 1.00 . A A . 4 LEU HB2 1 1 19 2324 1 1 4 LEU HB3 H -2.659 1.343 -4.048 1.00 . A A . 4 LEU HB3 1 1 19 2325 1 1 4 LEU HD11 H -5.055 0.563 -1.755 1.00 . A A . 4 LEU HD11 1 1 19 2326 1 1 4 LEU HD12 H -4.411 -1.022 -1.335 1.00 . A A . 4 LEU HD12 1 1 19 2327 1 1 4 LEU HD13 H -5.692 -0.882 -2.540 1.00 . A A . 4 LEU HD13 1 1 19 2328 1 1 4 LEU HD21 H -3.719 -0.898 -5.271 1.00 . A A . 4 LEU HD21 1 1 19 2329 1 1 4 LEU HD22 H -4.593 0.606 -4.981 1.00 . A A . 4 LEU HD22 1 1 19 2330 1 1 4 LEU HD23 H -5.320 -0.936 -4.531 1.00 . A A . 4 LEU HD23 1 1 19 2331 1 1 4 LEU HG H -3.062 -1.099 -3.109 1.00 . A A . 4 LEU HG 1 1 19 2332 1 1 4 LEU N N -2.137 0.208 -0.941 1.00 . A A . 4 LEU N 1 1 19 2333 1 1 4 LEU O O -2.129 3.172 -1.200 1.00 . A A . 4 LEU O 1 1 19 2334 1 1 5 ARG C C 0.927 4.716 -3.056 1.00 . A A . 5 ARG C 1 1 19 2335 1 1 5 ARG CA C 0.442 4.029 -1.783 1.00 . A A . 5 ARG CA 1 1 19 2336 1 1 5 ARG CB C 1.594 3.906 -0.782 1.00 . A A . 5 ARG CB 1 1 19 2337 1 1 5 ARG CD C 2.261 6.059 0.337 1.00 . A A . 5 ARG CD 1 1 19 2338 1 1 5 ARG CG C 1.428 4.791 0.444 1.00 . A A . 5 ARG CG 1 1 19 2339 1 1 5 ARG CZ C 0.722 7.634 1.442 1.00 . A A . 5 ARG CZ 1 1 19 2340 1 1 5 ARG H H 0.455 2.047 -2.525 1.00 . A A . 5 ARG H 1 1 19 2341 1 1 5 ARG HA H -0.342 4.626 -1.342 1.00 . A A . 5 ARG HA 1 1 19 2342 1 1 5 ARG HB2 H 1.657 2.877 -0.449 1.00 . A A . 5 ARG HB2 1 1 19 2343 1 1 5 ARG HB3 H 2.519 4.180 -1.276 1.00 . A A . 5 ARG HB3 1 1 19 2344 1 1 5 ARG HD2 H 2.960 6.086 1.159 1.00 . A A . 5 ARG HD2 1 1 19 2345 1 1 5 ARG HD3 H 2.805 6.042 -0.597 1.00 . A A . 5 ARG HD3 1 1 19 2346 1 1 5 ARG HE H 1.402 7.820 -0.424 1.00 . A A . 5 ARG HE 1 1 19 2347 1 1 5 ARG HG2 H 0.388 5.063 0.541 1.00 . A A . 5 ARG HG2 1 1 19 2348 1 1 5 ARG HG3 H 1.741 4.239 1.318 1.00 . A A . 5 ARG HG3 1 1 19 2349 1 1 5 ARG HH11 H 1.288 6.069 2.592 1.00 . A A . 5 ARG HH11 1 1 19 2350 1 1 5 ARG HH12 H 0.204 7.189 3.345 1.00 . A A . 5 ARG HH12 1 1 19 2351 1 1 5 ARG HH21 H -0.024 9.295 0.565 1.00 . A A . 5 ARG HH21 1 1 19 2352 1 1 5 ARG HH22 H -0.542 9.020 2.195 1.00 . A A . 5 ARG HH22 1 1 19 2353 1 1 5 ARG N N -0.110 2.713 -2.080 1.00 . A A . 5 ARG N 1 1 19 2354 1 1 5 ARG NE N 1.432 7.262 0.380 1.00 . A A . 5 ARG NE 1 1 19 2355 1 1 5 ARG NH1 N 0.739 6.904 2.551 1.00 . A A . 5 ARG NH1 1 1 19 2356 1 1 5 ARG NH2 N -0.008 8.740 1.397 1.00 . A A . 5 ARG NH2 1 1 19 2357 1 1 5 ARG O O 1.231 4.058 -4.051 1.00 . A A . 5 ARG O 1 1 19 2358 1 1 6 HIS C C 1.942 8.194 -3.736 1.00 . A A . 6 HIS C 1 1 19 2359 1 1 6 HIS CA C 1.444 6.819 -4.168 1.00 . A A . 6 HIS CA 1 1 19 2360 1 1 6 HIS CB C 0.307 6.969 -5.181 1.00 . A A . 6 HIS CB 1 1 19 2361 1 1 6 HIS CD2 C -1.427 7.768 -3.424 1.00 . A A . 6 HIS CD2 1 1 19 2362 1 1 6 HIS CE1 C -2.566 9.140 -4.699 1.00 . A A . 6 HIS CE1 1 1 19 2363 1 1 6 HIS CG C -0.865 7.740 -4.656 1.00 . A A . 6 HIS CG 1 1 19 2364 1 1 6 HIS H H 0.740 6.511 -2.196 1.00 . A A . 6 HIS H 1 1 19 2365 1 1 6 HIS HA H 2.258 6.283 -4.631 1.00 . A A . 6 HIS HA 1 1 19 2366 1 1 6 HIS HB2 H 0.680 7.488 -6.056 1.00 . A A . 6 HIS HB2 1 1 19 2367 1 1 6 HIS HB3 H -0.043 5.984 -5.467 1.00 . A A . 6 HIS HB3 1 1 19 2368 1 1 6 HIS HD1 H -1.443 8.809 -6.377 1.00 . A A . 6 HIS HD1 1 1 19 2369 1 1 6 HIS HD2 H -1.105 7.204 -2.559 1.00 . A A . 6 HIS HD2 1 1 19 2370 1 1 6 HIS HE1 H -3.300 9.855 -5.042 1.00 . A A . 6 HIS HE1 1 1 19 2371 1 1 6 HIS HE2 H -3.130 8.801 -2.760 1.00 . A A . 6 HIS HE2 1 1 19 2372 1 1 6 HIS N N 0.996 6.043 -3.017 1.00 . A A . 6 HIS N 1 1 19 2373 1 1 6 HIS ND1 N -1.602 8.610 -5.431 1.00 . A A . 6 HIS ND1 1 1 19 2374 1 1 6 HIS NE2 N -2.482 8.645 -3.478 1.00 . A A . 6 HIS NE2 1 1 19 2375 1 1 6 HIS O O 1.898 9.126 -4.566 1.00 . A A . 6 HIS O 1 1 20 2376 1 1 1 HIS C C 0.002 -6.624 3.206 1.00 . A A . 1 HIS C 1 1 20 2377 1 1 1 HIS CA C -0.169 -8.086 2.804 1.00 . A A . 1 HIS CA 1 1 20 2378 1 1 1 HIS CB C 1.058 -8.570 2.027 1.00 . A A . 1 HIS CB 1 1 20 2379 1 1 1 HIS CD2 C 1.611 -11.104 2.089 1.00 . A A . 1 HIS CD2 1 1 20 2380 1 1 1 HIS CE1 C 2.763 -11.135 3.954 1.00 . A A . 1 HIS CE1 1 1 20 2381 1 1 1 HIS CG C 1.646 -9.837 2.567 1.00 . A A . 1 HIS CG 1 1 20 2382 1 1 1 HIS H1 H -2.168 -7.793 2.419 1.00 . A A . 1 HIS H1 1 1 20 2383 1 1 1 HIS H2 H -1.544 -9.293 1.864 1.00 . A A . 1 HIS H2 1 1 20 2384 1 1 1 HIS H3 H -1.173 -7.842 1.025 1.00 . A A . 1 HIS H3 1 1 20 2385 1 1 1 HIS HA H -0.285 -8.685 3.695 1.00 . A A . 1 HIS HA 1 1 20 2386 1 1 1 HIS HB2 H 0.777 -8.747 1.000 1.00 . A A . 1 HIS HB2 1 1 20 2387 1 1 1 HIS HB3 H 1.822 -7.807 2.060 1.00 . A A . 1 HIS HB3 1 1 20 2388 1 1 1 HIS HD1 H 2.577 -9.130 4.320 1.00 . A A . 1 HIS HD1 1 1 20 2389 1 1 1 HIS HD2 H 1.123 -11.434 1.183 1.00 . A A . 1 HIS HD2 1 1 20 2390 1 1 1 HIS HE1 H 3.349 -11.475 4.795 1.00 . A A . 1 HIS HE1 1 1 20 2391 1 1 1 HIS HE2 H 2.533 -12.835 2.837 1.00 . A A . 1 HIS HE2 1 1 20 2392 1 1 1 HIS N N -1.372 -8.270 1.951 1.00 . A A . 1 HIS N 1 1 20 2393 1 1 1 HIS ND1 N 2.374 -9.891 3.736 1.00 . A A . 1 HIS ND1 1 1 20 2394 1 1 1 HIS NE2 N 2.312 -11.890 2.970 1.00 . A A . 1 HIS NE2 1 1 20 2395 1 1 1 HIS O O -0.004 -6.292 4.391 1.00 . A A . 1 HIS O 1 1 20 2396 1 1 2 ARG C C -0.595 -3.505 1.571 1.00 . A A . 2 ARG C 1 1 20 2397 1 1 2 ARG CA C 0.328 -4.330 2.461 1.00 . A A . 2 ARG CA 1 1 20 2398 1 1 2 ARG CB C 1.783 -3.922 2.224 1.00 . A A . 2 ARG CB 1 1 20 2399 1 1 2 ARG CD C 3.879 -4.547 0.986 1.00 . A A . 2 ARG CD 1 1 20 2400 1 1 2 ARG CG C 2.363 -4.462 0.926 1.00 . A A . 2 ARG CG 1 1 20 2401 1 1 2 ARG CZ C 5.724 -5.263 -0.484 1.00 . A A . 2 ARG CZ 1 1 20 2402 1 1 2 ARG H H 0.151 -6.082 1.287 1.00 . A A . 2 ARG H 1 1 20 2403 1 1 2 ARG HA H 0.074 -4.141 3.494 1.00 . A A . 2 ARG HA 1 1 20 2404 1 1 2 ARG HB2 H 1.844 -2.844 2.199 1.00 . A A . 2 ARG HB2 1 1 20 2405 1 1 2 ARG HB3 H 2.385 -4.289 3.042 1.00 . A A . 2 ARG HB3 1 1 20 2406 1 1 2 ARG HD2 H 4.283 -3.546 0.998 1.00 . A A . 2 ARG HD2 1 1 20 2407 1 1 2 ARG HD3 H 4.163 -5.060 1.893 1.00 . A A . 2 ARG HD3 1 1 20 2408 1 1 2 ARG HE H 3.810 -5.780 -0.714 1.00 . A A . 2 ARG HE 1 1 20 2409 1 1 2 ARG HG2 H 1.964 -5.450 0.749 1.00 . A A . 2 ARG HG2 1 1 20 2410 1 1 2 ARG HG3 H 2.079 -3.806 0.116 1.00 . A A . 2 ARG HG3 1 1 20 2411 1 1 2 ARG HH11 H 6.287 -4.059 1.041 1.00 . A A . 2 ARG HH11 1 1 20 2412 1 1 2 ARG HH12 H 7.565 -4.578 -0.006 1.00 . A A . 2 ARG HH12 1 1 20 2413 1 1 2 ARG HH21 H 5.490 -6.465 -2.092 1.00 . A A . 2 ARG HH21 1 1 20 2414 1 1 2 ARG HH22 H 7.113 -5.944 -1.785 1.00 . A A . 2 ARG HH22 1 1 20 2415 1 1 2 ARG N N 0.155 -5.756 2.211 1.00 . A A . 2 ARG N 1 1 20 2416 1 1 2 ARG NE N 4.433 -5.267 -0.159 1.00 . A A . 2 ARG NE 1 1 20 2417 1 1 2 ARG NH1 N 6.597 -4.577 0.244 1.00 . A A . 2 ARG NH1 1 1 20 2418 1 1 2 ARG NH2 N 6.143 -5.946 -1.540 1.00 . A A . 2 ARG NH2 1 1 20 2419 1 1 2 ARG O O -1.215 -4.031 0.647 1.00 . A A . 2 ARG O 1 1 20 2420 1 1 3 PHE C C -0.744 -0.645 -0.038 1.00 . A A . 3 PHE C 1 1 20 2421 1 1 3 PHE CA C -1.530 -1.313 1.082 1.00 . A A . 3 PHE CA 1 1 20 2422 1 1 3 PHE CB C -2.160 -0.257 1.988 1.00 . A A . 3 PHE CB 1 1 20 2423 1 1 3 PHE CD1 C -4.449 -1.189 1.491 1.00 . A A . 3 PHE CD1 1 1 20 2424 1 1 3 PHE CD2 C -4.245 1.141 1.962 1.00 . A A . 3 PHE CD2 1 1 20 2425 1 1 3 PHE CE1 C -5.813 -1.041 1.332 1.00 . A A . 3 PHE CE1 1 1 20 2426 1 1 3 PHE CE2 C -5.609 1.294 1.802 1.00 . A A . 3 PHE CE2 1 1 20 2427 1 1 3 PHE CG C -3.648 -0.100 1.808 1.00 . A A . 3 PHE CG 1 1 20 2428 1 1 3 PHE CZ C -6.394 0.202 1.487 1.00 . A A . 3 PHE CZ 1 1 20 2429 1 1 3 PHE H H -0.164 -1.850 2.606 1.00 . A A . 3 PHE H 1 1 20 2430 1 1 3 PHE HA H -2.312 -1.901 0.642 1.00 . A A . 3 PHE HA 1 1 20 2431 1 1 3 PHE HB2 H -1.977 -0.523 3.022 1.00 . A A . 3 PHE HB2 1 1 20 2432 1 1 3 PHE HB3 H -1.700 0.696 1.774 1.00 . A A . 3 PHE HB3 1 1 20 2433 1 1 3 PHE HD1 H -3.997 -2.162 1.367 1.00 . A A . 3 PHE HD1 1 1 20 2434 1 1 3 PHE HD2 H -3.633 1.996 2.207 1.00 . A A . 3 PHE HD2 1 1 20 2435 1 1 3 PHE HE1 H -6.424 -1.896 1.085 1.00 . A A . 3 PHE HE1 1 1 20 2436 1 1 3 PHE HE2 H -6.062 2.267 1.924 1.00 . A A . 3 PHE HE2 1 1 20 2437 1 1 3 PHE HZ H -7.460 0.320 1.363 1.00 . A A . 3 PHE HZ 1 1 20 2438 1 1 3 PHE N N -0.682 -2.210 1.857 1.00 . A A . 3 PHE N 1 1 20 2439 1 1 3 PHE O O 0.481 -0.747 -0.101 1.00 . A A . 3 PHE O 1 1 20 2440 1 1 4 LEU C C -0.441 2.140 -1.683 1.00 . A A . 4 LEU C 1 1 20 2441 1 1 4 LEU CA C -0.840 0.716 -2.053 1.00 . A A . 4 LEU CA 1 1 20 2442 1 1 4 LEU CB C -1.786 0.730 -3.253 1.00 . A A . 4 LEU CB 1 1 20 2443 1 1 4 LEU CD1 C -3.816 -0.598 -2.652 1.00 . A A . 4 LEU CD1 1 1 20 2444 1 1 4 LEU CD2 C -2.858 -0.763 -4.959 1.00 . A A . 4 LEU CD2 1 1 20 2445 1 1 4 LEU CG C -2.545 -0.576 -3.481 1.00 . A A . 4 LEU CG 1 1 20 2446 1 1 4 LEU H H -2.434 0.074 -0.821 1.00 . A A . 4 LEU H 1 1 20 2447 1 1 4 LEU HA H 0.043 0.162 -2.317 1.00 . A A . 4 LEU HA 1 1 20 2448 1 1 4 LEU HB2 H -2.506 1.523 -3.109 1.00 . A A . 4 LEU HB2 1 1 20 2449 1 1 4 LEU HB3 H -1.209 0.945 -4.139 1.00 . A A . 4 LEU HB3 1 1 20 2450 1 1 4 LEU HD11 H -3.907 0.334 -2.115 1.00 . A A . 4 LEU HD11 1 1 20 2451 1 1 4 LEU HD12 H -3.767 -1.415 -1.948 1.00 . A A . 4 LEU HD12 1 1 20 2452 1 1 4 LEU HD13 H -4.670 -0.728 -3.299 1.00 . A A . 4 LEU HD13 1 1 20 2453 1 1 4 LEU HD21 H -2.774 -1.808 -5.215 1.00 . A A . 4 LEU HD21 1 1 20 2454 1 1 4 LEU HD22 H -2.158 -0.190 -5.550 1.00 . A A . 4 LEU HD22 1 1 20 2455 1 1 4 LEU HD23 H -3.862 -0.421 -5.160 1.00 . A A . 4 LEU HD23 1 1 20 2456 1 1 4 LEU HG H -1.929 -1.403 -3.159 1.00 . A A . 4 LEU HG 1 1 20 2457 1 1 4 LEU N N -1.462 0.034 -0.926 1.00 . A A . 4 LEU N 1 1 20 2458 1 1 4 LEU O O -1.066 2.769 -0.829 1.00 . A A . 4 LEU O 1 1 20 2459 1 1 5 ARG C C 0.944 4.872 -3.311 1.00 . A A . 5 ARG C 1 1 20 2460 1 1 5 ARG CA C 1.088 3.995 -2.072 1.00 . A A . 5 ARG CA 1 1 20 2461 1 1 5 ARG CB C 2.549 3.958 -1.626 1.00 . A A . 5 ARG CB 1 1 20 2462 1 1 5 ARG CD C 3.694 6.191 -1.730 1.00 . A A . 5 ARG CD 1 1 20 2463 1 1 5 ARG CG C 2.972 5.190 -0.843 1.00 . A A . 5 ARG CG 1 1 20 2464 1 1 5 ARG CZ C 4.708 7.812 -0.174 1.00 . A A . 5 ARG CZ 1 1 20 2465 1 1 5 ARG H H 1.061 2.094 -3.002 1.00 . A A . 5 ARG H 1 1 20 2466 1 1 5 ARG HA H 0.490 4.415 -1.277 1.00 . A A . 5 ARG HA 1 1 20 2467 1 1 5 ARG HB2 H 2.701 3.089 -0.996 1.00 . A A . 5 ARG HB2 1 1 20 2468 1 1 5 ARG HB3 H 3.181 3.880 -2.503 1.00 . A A . 5 ARG HB3 1 1 20 2469 1 1 5 ARG HD2 H 4.687 5.820 -1.936 1.00 . A A . 5 ARG HD2 1 1 20 2470 1 1 5 ARG HD3 H 3.148 6.291 -2.656 1.00 . A A . 5 ARG HD3 1 1 20 2471 1 1 5 ARG HE H 3.162 8.194 -1.377 1.00 . A A . 5 ARG HE 1 1 20 2472 1 1 5 ARG HG2 H 2.092 5.661 -0.429 1.00 . A A . 5 ARG HG2 1 1 20 2473 1 1 5 ARG HG3 H 3.630 4.888 -0.044 1.00 . A A . 5 ARG HG3 1 1 20 2474 1 1 5 ARG HH11 H 5.578 5.986 -0.164 1.00 . A A . 5 ARG HH11 1 1 20 2475 1 1 5 ARG HH12 H 6.268 7.143 0.924 1.00 . A A . 5 ARG HH12 1 1 20 2476 1 1 5 ARG HH21 H 4.071 9.716 0.050 1.00 . A A . 5 ARG HH21 1 1 20 2477 1 1 5 ARG HH22 H 5.414 9.261 1.045 1.00 . A A . 5 ARG HH22 1 1 20 2478 1 1 5 ARG N N 0.604 2.644 -2.332 1.00 . A A . 5 ARG N 1 1 20 2479 1 1 5 ARG NE N 3.801 7.504 -1.098 1.00 . A A . 5 ARG NE 1 1 20 2480 1 1 5 ARG NH1 N 5.590 6.905 0.228 1.00 . A A . 5 ARG NH1 1 1 20 2481 1 1 5 ARG NH2 N 4.733 9.029 0.350 1.00 . A A . 5 ARG NH2 1 1 20 2482 1 1 5 ARG O O 1.177 4.423 -4.433 1.00 . A A . 5 ARG O 1 1 20 2483 1 1 6 HIS C C 0.506 8.507 -3.709 1.00 . A A . 6 HIS C 1 1 20 2484 1 1 6 HIS CA C 0.384 7.068 -4.200 1.00 . A A . 6 HIS CA 1 1 20 2485 1 1 6 HIS CB C -0.976 6.857 -4.867 1.00 . A A . 6 HIS CB 1 1 20 2486 1 1 6 HIS CD2 C -2.460 6.580 -2.757 1.00 . A A . 6 HIS CD2 1 1 20 2487 1 1 6 HIS CE1 C -4.008 8.049 -3.259 1.00 . A A . 6 HIS CE1 1 1 20 2488 1 1 6 HIS CG C -2.135 7.119 -3.956 1.00 . A A . 6 HIS CG 1 1 20 2489 1 1 6 HIS H H 0.387 6.427 -2.183 1.00 . A A . 6 HIS H 1 1 20 2490 1 1 6 HIS HA H 1.162 6.879 -4.924 1.00 . A A . 6 HIS HA 1 1 20 2491 1 1 6 HIS HB2 H -1.062 7.526 -5.714 1.00 . A A . 6 HIS HB2 1 1 20 2492 1 1 6 HIS HB3 H -1.046 5.830 -5.210 1.00 . A A . 6 HIS HB3 1 1 20 2493 1 1 6 HIS HD1 H -3.174 8.594 -5.046 1.00 . A A . 6 HIS HD1 1 1 20 2494 1 1 6 HIS HD2 H -1.904 5.822 -2.223 1.00 . A A . 6 HIS HD2 1 1 20 2495 1 1 6 HIS HE1 H -4.891 8.670 -3.210 1.00 . A A . 6 HIS HE1 1 1 20 2496 1 1 6 HIS HE2 H -4.150 6.918 -1.558 1.00 . A A . 6 HIS HE2 1 1 20 2497 1 1 6 HIS N N 0.558 6.127 -3.100 1.00 . A A . 6 HIS N 1 1 20 2498 1 1 6 HIS ND1 N -3.126 8.036 -4.242 1.00 . A A . 6 HIS ND1 1 1 20 2499 1 1 6 HIS NE2 N -3.628 7.175 -2.346 1.00 . A A . 6 HIS NE2 1 1 20 2500 1 1 6 HIS O O 1.464 9.193 -4.124 1.00 . A A . 6 HIS O 1 1 stop_ save_
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